4-[(5-acetamido-4-cyano-3-methyl-thiophen-2-yl)methyl]-N-(2-aminophenyl)benzamide

Systemtic Name: 4-[(5-acetamido-4-cyano-3-methyl-thiophen-2-yl)methyl]-N-(2-aminophenyl)benzamide Openeye Name: 4-[(5-acetamido-4-cyano-3-methyl-2-thienyl)methyl]-N-(2-aminophenyl)benzamide CAS Name: 4-[(5-acetamido-4-cyano-3-methyl-2-thiophenyl)methyl]-N-(2-aminophenyl)benzamide IUPAC Name: 4-[(5-acetamido-4-cyano-3-methylthiophen-2-yl)methyl]-N-(2-aminophenyl)benzamide Traditional Name: 4-[(5-acetamido-4-cyano-3-methyl-2-thienyl)methyl]-N-(2-aminophenyl)benzamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

InChI

InChI=1S/C22H20N4O2S/c1-13-17(12-23)22(25-14(2)27)29-20(13)11-15-7-9-16(10-8-15)21(28)26-19-6-4-3-5-18(19)24/h3-10H,11,24H2,1-2H3,(H,25,27)(H,26,28)