2-(3-aminophenyl)sulfanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide

Systemtic Name: 2-(3-aminophenyl)sulfanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Openeye Name: 2-(3-aminophenyl)sulfanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanamide CAS Name: 2-[(3-aminophenyl)thio]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide IUPAC Name: 2-(3-aminophenyl)sulfanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Traditional Name: 2-[(3-aminophenyl)thio]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C19H21N3OS2 MolecularWeight: 371.51954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C)SC3=CC=CC(=C3)N

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C)SC3=CC=CC(=C3)N

InChI

InChI=1S/C19H21N3OS2/c1-11-6-7-15-16(10-20)19(25-17(15)8-11)22-18(23)12(2)24-14-5-3-4-13(21)9-14/h3-5,9,11-12H,6-8,21H2,1-2H3,(H,22,23)