N-[(2-methylsulfanylphenyl)methyl]-2-[1-(4-propan-2-yloxyphenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(2-methylsulfanylphenyl)methyl]-2-[1-(4-propan-2-yloxyphenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(4-isopropoxybenzoyl)-4-piperidyl]-N-[(2-methylsulfanylphenyl)methyl]thiazole-4-carboxamide CAS Name: N-[[2-(methylthio)phenyl]methyl]-2-[1-[oxo-(4-propan-2-yloxyphenyl)methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-[(2-methylsulfanylphenyl)methyl]-2-[1-(4-propan-2-yloxybenzoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-(4-isopropoxybenzoyl)-4-piperidyl]-N-[2-(methylthio)benzyl]thiazole-4-carboxamide Formula: C27H31N3O3S2 MolecularWeight: 509.68334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=CC=C4SC

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=CC=C4SC

InChI

InChI=1S/C27H31N3O3S2/c1-18(2)33-22-10-8-20(9-11-22)27(32)30-14-12-19(13-15-30)26-29-23(17-35-26)25(31)28-16-21-6-4-5-7-24(21)34-3/h4-11,17-19H,12-16H2,1-3H3,(H,28,31)