[4-[2,6-bis(chloranyl)phenyl]-5-methoxycarbonyloxy-2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-(phenylsulfinylmethyl)-1,4-dihydropyridin-3-yl] methyl carbonate

Systemtic Name: [4-[2,6-bis(chloranyl)phenyl]-5-methoxycarbonyloxy-2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-(phenylsulfinylmethyl)-1,4-dihydropyridin-3-yl] methyl carbonate Openeye Name: [2-(benzenesulfinylmethyl)-4-(2,6-dichlorophenyl)-5-methoxycarbonyloxy-6-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1,4-dihydropyridin-3-yl] methyl carbonate CAS Name: carbonic acid [2-(benzenesulfinylmethyl)-4-(2,6-dichlorophenyl)-5-methoxycarbonyloxy-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-1,4-dihydropyridin-3-yl] methyl ester IUPAC Name: [2-(benzenesulfinylmethyl)-4-(2,6-dichlorophenyl)-5-methoxycarbonyloxy-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,4-dihydropyridin-3-yl] methyl carbonate Traditional Name: carbonic acid [2-(benzenesulfinylmethyl)-5-carbomethoxyoxy-4-(2,6-dichlorophenyl)-6-[2-keto-2-(4-methylpiperazino)ethyl]-1,4-dihydropyridin-3-yl] methyl ester Formula: C29H31Cl2N3O8S MolecularWeight: 652.54274

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CC2=C(C(C(=C(N2)CS(=O)C3=CC=CC=C3)OC(=O)OC)C4=C(C=CC=C4Cl)Cl)OC(=O)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)CC2=C(C(C(=C(N2)CS(=O)C3=CC=CC=C3)OC(=O)OC)C4=C(C=CC=C4Cl)Cl)OC(=O)OC

InChI

InChI=1S/C29H31Cl2N3O8S/c1-33-12-14-34(15-13-33)23(35)16-21-26(41-28(36)39-2)25(24-19(30)10-7-11-20(24)31)27(42-29(37)40-3)22(32-21)17-43(38)18-8-5-4-6-9-18/h4-11,25,32H,12-17H2,1-3H3