4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-methoxy-5-piperidinosulfonyl-phenyl)benzamide Formula: C29H33N3O4S MolecularWeight: 519.65502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H33N3O4S/c1-36-28-14-13-26(37(34,35)32-16-5-2-6-17-32)19-27(28)30-29(33)24-11-9-22(10-12-24)20-31-18-15-23-7-3-4-8-25(23)21-31/h3-4,7-14,19H,2,5-6,15-18,20-21H2,1H3,(H,30,33)