103654-21-3
N-METHYL-3-(PHENYLTHIO)-1H-INDOLE-5-METHANESULFONAMIDE
NameN-METHYL-3-(PHENYLTHIO)-1H-INDOLE-5-METHANESULFONAMIDE
1Identification
【Name】
N-METHYL-3-(PHENYLTHIO)-1H-INDOLE-5-METHANESULFONAMIDE
【CAS】
【MDL】
MFCD09833106
【English Synonyms】
【Formula】
C16 H16 N2 O2 S2
【MolWeight】
332.446
【Inchi】
InChI=1S/C16H16N2O2S2/c1-17-22(19,20)11-12-7-8-15-14(9-12)16(10-18-15)21-13-5-3-2-4-6-13/h2-10,17-18H,11H2,1H3
【InChIKey】
InChIKey=FXDXFQYSFOSJBS-UHFFFAOYSA-N
【SMILES】
CNS(=O)(=O)Cc1ccc2c(c1)c(c[nH]2)Sc3ccccc3
【MOL File】
N-METHYL-3-(PHENYLTH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-METHYL-3-(PHENYLTHIO)-1H-INDOLE-5-METHANESULFONAMIDE.cml