4-[2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)N2CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)N2CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C16H19N5O3S/c1-2-3-8-20-15(24)18-19-16(20)25-10-14(23)21-9-13(22)17-11-6-4-5-7-12(11)21/h4-7H,2-3,8-10H2,1H3,(H,17,22)(H,18,24)