2-[3,5-bis(chloranyl)phenyl]sulfonyl-5-piperazin-1-yl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[3,5-bis(chloranyl)phenyl]sulfonyl-5-piperazin-1-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3,5-dichlorophenyl)sulfonyl-5-piperazin-1-yl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(3,5-dichlorophenyl)sulfonyl-5-(1-piperazinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3,5-dichlorophenyl)sulfonyl-5-piperazin-1-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3,5-dichlorophenyl)sulfonyl-5-piperazino-3,4-dihydro-1H-isoquinoline Formula: C19H21Cl2N3O2S MolecularWeight: 426.35994

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=CC=C2)N3CCNCC3)S(=O)(=O)C4=CC(=CC(=C4)Cl)Cl

Isomeric SMILES

C1CN(CC2=C1C(=CC=C2)N3CCNCC3)S(=O)(=O)C4=CC(=CC(=C4)Cl)Cl

InChI

InChI=1S/C19H21Cl2N3O2S/c20-15-10-16(21)12-17(11-15)27(25,26)24-7-4-18-14(13-24)2-1-3-19(18)23-8-5-22-6-9-23/h1-3,10-12,22H,4-9,13H2