N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenyl-butanamide

Systemtic Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenyl-butanamide Openeye Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenyl-butanamide CAS Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenylbutanamide IUPAC Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenylbutanamide Traditional Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenyl-butyramide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NCCS(=O)(=O)N2CCC3=C(C2)C=CC(=C3)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NCCS(=O)(=O)N2CCC3=C(C2)C=CC(=C3)OC

InChI

InChI=1S/C22H28N2O4S/c1-3-21(17-7-5-4-6-8-17)22(25)23-12-14-29(26,27)24-13-11-18-15-20(28-2)10-9-19(18)16-24/h4-10,15,21H,3,11-14,16H2,1-2H3,(H,23,25)