N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CNC(=S)N2C3=CC=CC=C3)N4CCCC4=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CNC(=S)N2C3=CC=CC=C3)N4CCCC4=O

InChI

InChI=1S/C21H20N4O3S/c1-28-18-12-14(9-10-16(18)24-11-5-8-19(24)26)23-20(27)17-13-22-21(29)25(17)15-6-3-2-4-7-15/h2-4,6-7,9-10,12-13H,5,8,11H2,1H3,(H,22,29)(H,23,27)