N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H16N6O2S MolecularWeight: 380.42364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C18H16N6O2S/c1-11(27-18-23-19-10-24(18)13-5-3-2-4-6-13)16(25)20-12-7-8-14-15(9-12)22-17(26)21-14/h2-11H,1H3,(H,20,25)(H2,21,22,26)