1-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethanone Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)N2CCCC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)N2CCCC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3S/c1-2-4-14-17-16(19-18-14)25-10-15(22)20-8-3-5-11-9-12(21(23)24)6-7-13(11)20/h6-7,9H,2-5,8,10H2,1H3,(H,17,18,19)