N-(diphenylmethyl)-2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(diphenylmethyl)-2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-benzhydryl-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(diphenylmethyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-benzhydryl-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzhydryl-2-[[5-keto-4-(3-methoxypropyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-28-14-8-13-25-20(27)23-24-21(25)29-15-18(26)22-19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-7,9-12,19H,8,13-15H2,1H3,(H,22,26)(H,23,27)