1-[4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]piperidin-1-yl]-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-[4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]piperidin-1-yl]-3-phenyl-prop-2-yn-1-one Openeye Name: 1-[4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-1-piperidyl]-3-phenyl-prop-2-yn-1-one CAS Name: 1-[4-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-1-piperidinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 1-[4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]piperidin-1-yl]-3-phenylprop-2-yn-1-one Traditional Name: 1-[4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]piperidino]-3-phenyl-prop-2-yn-1-one Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3)C(=O)C#CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3)C(=O)C#CC5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c31-25(11-10-20-6-2-1-3-7-20)29-15-13-22(14-16-29)26-28-24(19-33-26)27(32)30-17-12-21-8-4-5-9-23(21)18-30/h1-9,19,22H,12-18H2