N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4-diethoxy-benzamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4-diethoxy-benzamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4-diethoxy-benzamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4-diethoxybenzamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4-diethoxybenzamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-2,4-diethoxy-benzamide Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)OCC

InChI

InChI=1S/C26H28N2O5S/c1-3-32-22-11-14-24(25(17-22)33-4-2)26(29)27-21-9-12-23(13-10-21)34(30,31)28-16-15-19-7-5-6-8-20(19)18-28/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,27,29)