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

Systemtic Name: 3-phenyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: 3-phenyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CNC(=S)N2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1NC(=O)C2=CNC(=S)N2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4OS/c26-20(19-13-22-21(27)25(19)18-9-5-2-6-10-18)23-17-11-12-24(15-17)14-16-7-3-1-4-8-16/h1-10,13,17H,11-12,14-15H2,(H,22,27)(H,23,26)