N-(2-aminophenyl)-4-[[[(Z)-3-(4-methylsulfanylphenyl)-2-thiophen-2-yl-prop-2-enoyl]amino]methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[[[(Z)-3-(4-methylsulfanylphenyl)-2-thiophen-2-yl-prop-2-enoyl]amino]methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[[[(Z)-3-(4-methylsulfanylphenyl)-2-(2-thienyl)prop-2-enoyl]amino]methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[[[(Z)-3-[4-(methylthio)phenyl]-1-oxo-2-thiophen-2-ylprop-2-enyl]amino]methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[[[(Z)-3-(4-methylsulfanylphenyl)-2-thiophen-2-ylprop-2-enoyl]amino]methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[[[(Z)-3-[4-(methylthio)phenyl]-2-(2-thienyl)acryloyl]amino]methyl]benzamide Formula: C28H25N3O2S2 MolecularWeight: 499.647

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C2=CC=CS2)C(=O)NCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C(\C2=CC=CS2)/C(=O)NCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C28H25N3O2S2/c1-34-22-14-10-19(11-15-22)17-23(26-7-4-16-35-26)28(33)30-18-20-8-12-21(13-9-20)27(32)31-25-6-3-2-5-24(25)29/h2-17H,18,29H2,1H3,(H,30,33)(H,31,32)/b23-17+