N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide

Systemtic Name: N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclobutanecarboxamide Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

C1CC(C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C20H22N2O3S/c23-20(16-5-4-6-16)21-18-10-9-15-11-12-22(14-17(15)13-18)26(24,25)19-7-2-1-3-8-19/h1-3,7-10,13,16H,4-6,11-12,14H2,(H,21,23)