3-acetamido-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-3-(2-thienyl)-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]propanamide CAS Name: 3-acetamido-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-3-(2-thienyl)-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]propionamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC1=CC=CC(=C1)N2C=CNC2=S)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)NC1=CC=CC(=C1)N2C=CNC2=S)C3=CC=CS3

InChI

InChI=1S/C18H18N4O2S2/c1-12(23)20-15(16-6-3-9-26-16)11-17(24)21-13-4-2-5-14(10-13)22-8-7-19-18(22)25/h2-10,15H,11H2,1H3,(H,19,25)(H,20,23)(H,21,24)