[(3S)-2-(3,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3S)-2-(3,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3S)-2-(3,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(3S)-2-(3,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3S)-2-(3,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3S)-2-(3,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidino-methanone Formula: C20H20Cl2N2O3S MolecularWeight: 439.3554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O3S/c21-17-8-7-16(12-18(17)22)28(26,27)24-13-15-6-2-1-5-14(15)11-19(24)20(25)23-9-3-4-10-23/h1-2,5-8,12,19H,3-4,9-11,13H2/t19-/m0/s1