1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)ethanone

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)ethanone Openeye Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-piperidyl]-2-(4-methyl-2-thioxo-3H-thiazol-5-yl)ethanone CAS Name: 1-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-piperidinyl]-2-(4-methyl-2-sulfanylidene-3H-thiazol-5-yl)ethanone IUPAC Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)ethanone Traditional Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidino]-2-(4-methyl-2-thioxo-4-thiazolin-5-yl)ethanone Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=S)N1)CC(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(SC(=S)N1)CC(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H25N3O2S2/c1-14-18(28-21(27)22-14)12-19(25)23-9-7-16(8-10-23)20(26)24-11-6-15-4-2-3-5-17(15)13-24/h2-5,16H,6-13H2,1H3,(H,22,27)