3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-N,N-diethyl-1-methyl-4-oxidanylidene-quinoline-6-sulfonamide

Systemtic Name: 3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-N,N-diethyl-1-methyl-4-oxidanylidene-quinoline-6-sulfonamide Openeye Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-N,N-diethyl-1-methyl-4-oxo-quinoline-6-sulfonamide CAS Name: 3-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]-N,N-diethyl-1-methyl-4-oxo-6-quinolinesulfonamide IUPAC Name: 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-N,N-diethyl-1-methyl-4-oxoquinoline-6-sulfonamide Traditional Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-N,N-diethyl-4-keto-1-methyl-quinoline-6-sulfonamide Formula: C26H31ClN4O4S MolecularWeight: 531.06674

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C=C(C2=O)C(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C=C(C2=O)C(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C

InChI

InChI=1S/C26H31ClN4O4S/c1-5-31(6-2)36(34,35)20-9-10-23-21(16-20)25(32)22(17-28(23)4)26(33)30-13-11-29(12-14-30)24-15-19(27)8-7-18(24)3/h7-10,15-17H,5-6,11-14H2,1-4H3