N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-(4-piperidinosulfonylphenyl)propionamide Formula: C27H37N3O3S MolecularWeight: 483.66598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)(CNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C27H37N3O3S/c1-27(2,29-19-16-23-8-4-5-9-24(23)20-29)21-28-26(31)15-12-22-10-13-25(14-11-22)34(32,33)30-17-6-3-7-18-30/h4-5,8-11,13-14H,3,6-7,12,15-21H2,1-2H3,(H,28,31)