3-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-6-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-1H-quinolin-4-one

Systemtic Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-6-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-1H-quinolin-4-one Openeye Name: 6-[(4-benzyl-1-piperidyl)sulfonyl]-3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1H-quinolin-4-one CAS Name: 3-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-6-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-1H-quinolin-4-one IUPAC Name: 6-(4-benzylpiperidin-1-yl)sulfonyl-3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1H-quinolin-4-one Traditional Name: 6-(4-benzylpiperidino)sulfonyl-3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4-quinolone Formula: C33H36N4O5S MolecularWeight: 600.72774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CNC4=C(C3=O)C=C(C=C4)S(=O)(=O)N5CCC(CC5)CC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CNC4=C(C3=O)C=C(C=C4)S(=O)(=O)N5CCC(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C33H36N4O5S/c1-42-27-9-7-26(8-10-27)35-17-19-36(20-18-35)33(39)30-23-34-31-12-11-28(22-29(31)32(30)38)43(40,41)37-15-13-25(14-16-37)21-24-5-3-2-4-6-24/h2-12,22-23,25H,13-21H2,1H3,(H,34,38)