(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Openeye Name: (4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(8-quinolylmethyl)piperazin-1-yl]methanone CAS Name: [4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-[4-(8-quinolinylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Traditional Name: (4-chloro-3-pyrrolidinosulfonyl-phenyl)-[4-(8-quinolylmethyl)piperazino]methanone Formula: C25H27ClN4O3S MolecularWeight: 499.02488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5)Cl

InChI

InChI=1S/C25H27ClN4O3S/c26-22-9-8-20(17-23(22)34(32,33)30-11-1-2-12-30)25(31)29-15-13-28(14-16-29)18-21-6-3-5-19-7-4-10-27-24(19)21/h3-10,17H,1-2,11-16,18H2