1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C15H18N4OS/c1-11-16-17-15(18(11)2)21-10-14(20)19-8-7-12-5-3-4-6-13(12)9-19/h3-6H,7-10H2,1-2H3