N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]phenyl]acetamide IUPAC Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]phenyl]acetamide Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H20N2O2S/c1-14(22)20-17-6-8-18(9-7-17)24-13-19(23)21-11-10-15-4-2-3-5-16(15)12-21/h2-9H,10-13H2,1H3,(H,20,22)