3-phenyl-2-sulfanylidene-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-imidazole-4-carboxamide

Systemtic Name: 3-phenyl-2-sulfanylidene-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-imidazole-4-carboxamide Openeye Name: 3-phenyl-2-thioxo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-imidazole-4-carboxamide CAS Name: 3-phenyl-2-sulfanylidene-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-imidazole-4-carboxamide IUPAC Name: 3-phenyl-2-sulfanylidene-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-imidazole-4-carboxamide Traditional Name: 3-phenyl-2-thioxo-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]-4-imidazoline-4-carboxamide Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CNC2=S)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CNC2=S)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H18N6OS/c27-19(18-11-23-20(28)26(18)17-4-2-1-3-5-17)22-10-15-6-8-16(9-7-15)12-25-14-21-13-24-25/h1-9,11,13-14H,10,12H2,(H,22,27)(H,23,28)