587846-14-8
3-CHLORO-N-ETHYL-N-(PHENYLMETHYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE
Name3-CHLORO-N-ETHYL-N-(PHENYLMETHYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE
1Identification
【Name】
3-CHLORO-N-ETHYL-N-(PHENYLMETHYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE
【CAS】
【MDL】
MFCD03638833
【English Synonyms】
【Formula】
C18 H16 Cl N O S
【MolWeight】
329.849
【Inchi】
InChI=1S/C18H16ClNOS/c1-2-20(12-13-8-4-3-5-9-13)18(21)17-16(19)14-10-6-7-11-15(14)22-17/h3-11H,2,12H2,1H3
【InChIKey】
InChIKey=CLMBJCGYAXQBTO-UHFFFAOYSA-N
【SMILES】
CCN(Cc1ccccc1)C(=O)c2c(c3ccccc3s2)Cl
【MOL File】
3-CHLORO-N-ETHYL-N-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-CHLORO-N-ETHYL-N-(PHENYLMETHYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE.cml