1-[1-(4-methylphenyl)-7-[(4-pyrrolidin-1-ylcarbonyl-1,3-thiazol-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one

Systemtic Name: 1-[1-(4-methylphenyl)-7-[(4-pyrrolidin-1-ylcarbonyl-1,3-thiazol-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 1-[1-(p-tolyl)-7-[[4-(pyrrolidine-1-carbonyl)thiazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 1-[1-(4-methylphenyl)-7-[[4-[oxo(1-pyrrolidinyl)methyl]-2-thiazolyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-1-propanone IUPAC Name: 1-[1-(4-methylphenyl)-7-[[4-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Traditional Name: 1-[1-(p-tolyl)-7-[[4-(pyrrolidine-1-carbonyl)thiazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=NC(=CS4)C(=O)N5CCCC5

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=NC(=CS4)C(=O)N5CCCC5

InChI

InChI=1S/C28H31N3O3S/c1-3-26(32)31-15-12-20-10-11-22(16-23(20)27(31)21-8-6-19(2)7-9-21)34-17-25-29-24(18-35-25)28(33)30-13-4-5-14-30/h6-11,16,18,27H,3-5,12-15,17H2,1-2H3