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

Systemtic Name: N-(2-aminophenyl)-4-[(5-benzamido-4-cyano-3-methyl-thiophen-2-yl)methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[(5-benzamido-4-cyano-3-methyl-2-thienyl)methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[(5-benzamido-4-cyano-3-methyl-2-thiophenyl)methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[(5-benzamido-4-cyano-3-methylthiophen-2-yl)methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[(5-benzamido-4-cyano-3-methyl-2-thienyl)methyl]benzamide Formula: C27H22N4O2S MolecularWeight: 466.55418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C27H22N4O2S/c1-17-21(16-28)27(31-26(33)19-7-3-2-4-8-19)34-24(17)15-18-11-13-20(14-12-18)25(32)30-23-10-6-5-9-22(23)29/h2-14H,15,29H2,1H3,(H,30,32)(H,31,33)