4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]-N-(4-dimethylaminophenyl)piperidine-1-carbothioamide

Systemtic Name: 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]-N-(4-dimethylaminophenyl)piperidine-1-carbothioamide Openeye Name: 4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-N-(4-dimethylaminophenyl)piperidine-1-carbothioamide CAS Name: 4-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-N-(4-dimethylaminophenyl)-1-piperidinecarbothioamide IUPAC Name: 4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]-N-(4-dimethylaminophenyl)piperidine-1-carbothioamide Traditional Name: 4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-N-(4-dimethylaminophenyl)piperidine-1-carbothioamide Formula: C27H31N5OS2 MolecularWeight: 505.69794

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H31N5OS2/c1-30(2)23-9-7-22(8-10-23)28-27(34)31-14-12-20(13-15-31)25-29-24(18-35-25)26(33)32-16-11-19-5-3-4-6-21(19)17-32/h3-10,18,20H,11-17H2,1-2H3,(H,28,34)