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

Systemtic Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-3,4-dimethyl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCS(=O)(=O)N2CCC3=C(C2)C=CC(=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCS(=O)(=O)N2CCC3=C(C2)C=CC(=C3)OC)C

InChI

InChI=1S/C21H26N2O4S/c1-15-4-5-18(12-16(15)2)21(24)22-9-11-28(25,26)23-10-8-17-13-20(27-3)7-6-19(17)14-23/h4-7,12-13H,8-11,14H2,1-3H3,(H,22,24)