4-cyclopropyl-3-[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopropyl-3-[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-cyclopropyl-3-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-cyclopropyl-3-[[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-cyclopropyl-3-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-cyclopropyl-3-[[2-keto-2-(2-phenyl-1H-indol-3-yl)ethyl]thio]-1H-1,2,4-triazol-5-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCC(=O)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCC(=O)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C21H18N4O2S/c26-17(12-28-21-24-23-20(27)25(21)14-10-11-14)18-15-8-4-5-9-16(15)22-19(18)13-6-2-1-3-7-13/h1-9,14,22H,10-12H2,(H,23,27)