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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1[N+]#[C-])NC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CC1=C(SC(=C1[N+]#[C-])NC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C27H22N4O2S/c1-17-23(34-27(24(17)29-2)31-26(33)19-8-4-3-5-9-19)16-18-12-14-20(15-13-18)25(32)30-22-11-7-6-10-21(22)28/h3-15H,16,28H2,1H3,(H,30,32)(H,31,33)