N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]ethanesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]ethanesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]ethanesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]ethanesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]ethanesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]ethanesulfonamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NCC(C1=CC=C(C=C1)N(C)C)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCS(=O)(=O)NCC(C1=CC=C(C=C1)N(C)C)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H29N3O2S/c1-4-27(25,26)22-15-21(18-9-11-20(12-10-18)23(2)3)24-14-13-17-7-5-6-8-19(17)16-24/h5-12,21-22H,4,13-16H2,1-3H3