2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C17H23N5OS/c1-2-3-10-15-19-20-17(22(15)18)24-12-16(23)21-11-6-8-13-7-4-5-9-14(13)21/h4-5,7,9H,2-3,6,8,10-12,18H2,1H3