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

Systemtic Name: 3-[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(2-phenyl-1H-indol-3-yl)ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-2-12-25-20(27)23-24-21(25)28-13-17(26)18-15-10-6-7-11-16(15)22-19(18)14-8-4-3-5-9-14/h3-11,22H,2,12-13H2,1H3,(H,23,27)