N-(3,4-dihydro-1H-isoquinolin-2-ylcarbothioyl)-3-methyl-benzamide

Systemtic Name: N-(3,4-dihydro-1H-isoquinolin-2-ylcarbothioyl)-3-methyl-benzamide Openeye Name: N-(3,4-dihydro-1H-isoquinoline-2-carbothioyl)-3-methyl-benzamide CAS Name: N-[3,4-dihydro-1H-isoquinolin-2-yl(sulfanylidene)methyl]-3-methylbenzamide IUPAC Name: N-(3,4-dihydro-1H-isoquinoline-2-carbothioyl)-3-methylbenzamide Traditional Name: N-(3,4-dihydro-1H-isoquinoline-2-carbothioyl)-3-methyl-benzamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=S)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(=S)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H18N2OS/c1-13-5-4-8-15(11-13)17(21)19-18(22)20-10-9-14-6-2-3-7-16(14)12-20/h2-8,11H,9-10,12H2,1H3,(H,19,21,22)