[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-quinolin-8-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-quinolin-8-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-[1-(8-quinolylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[1-(8-quinolinylsulfonyl)-4-piperidinyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(1-quinolin-8-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-[1-(8-quinolylsulfonyl)-4-piperidyl]methanone Formula: C26H29ClN4O3S MolecularWeight: 513.05146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C26H29ClN4O3S/c1-19-7-8-22(27)18-23(19)29-14-16-30(17-15-29)26(32)21-9-12-31(13-10-21)35(33,34)24-6-2-4-20-5-3-11-28-25(20)24/h2-8,11,18,21H,9-10,12-17H2,1H3