N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(methylthio)propyl]benzamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCC2=CC=CC=C2C1)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)N1CCC2=CC=CC=C2C1)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c1-26-14-12-19(22-20(24)17-8-3-2-4-9-17)21(25)23-13-11-16-7-5-6-10-18(16)15-23/h2-10,19H,11-15H2,1H3,(H,22,24)