550298-99-2
3-(4-AMINOBUTYL)-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOLE-5-CARBONITRILE
Name
3-(4-AMINOBUTYL)-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOLE-5-CARBONITRILE
Formula
C18 H19 N3 S
MolWeight
309.435
1Identification
【Name】
3-(4-AMINOBUTYL)-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOLE-5-CARBONITRILE
【CAS】
【MDL】
MFCD05195809
【English Synonyms】
【Formula】
C18 H19 N3 S
【MolWeight】
309.435
【Inchi】
InChI=1S/C18H19N3S/c1-12-8-17(22-11-12)18-14(4-2-3-7-19)15-9-13(10-20)5-6-16(15)21-18/h5-6,8-9,11,21H,2-4,7,19H2,1H3
【InChIKey】
InChIKey=PGANBUDYWIOOSC-UHFFFAOYSA-N
【SMILES】
Cc1cc(sc1)c2c(c3cc(ccc3[nH]2)C#N)CCCCN
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(4-AMINOBUTYL)-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOLE-5-CARBONITRILE.cml
Quick Release
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Aroma Circle Corp.
Catalog No:AC10285 1G
Catalog No:AC10285 5G
Country/Region:United States
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Catalog No:AC10285 1G
Catalog No:AC10285 5G
Country/Region:United States
Business Type:Others
http://www.aromacircle.com
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