1-(4-chlorophenyl)-5-[[1-(4-chlorophenyl)-6-oxidanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-5-yl]-[4-methoxy-3-(piperidin-1-ylmethyl)phenyl]methyl]-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(4-chlorophenyl)-5-[[1-(4-chlorophenyl)-6-oxidanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-5-yl]-[4-methoxy-3-(piperidin-1-ylmethyl)phenyl]methyl]-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(4-chlorophenyl)-5-[[1-(4-chlorophenyl)-6-hydroxy-4-oxo-2-thioxo-pyrimidin-5-yl]-[4-methoxy-3-(1-piperidylmethyl)phenyl]methyl]-6-hydroxy-2-thioxo-pyrimidin-4-one CAS Name: 1-(4-chlorophenyl)-5-[[1-(4-chlorophenyl)-6-hydroxy-4-oxo-2-sulfanylidene-5-pyrimidinyl]-[4-methoxy-3-(1-piperidinylmethyl)phenyl]methyl]-6-hydroxy-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(4-chlorophenyl)-5-[[1-(4-chlorophenyl)-6-hydroxy-4-oxo-2-sulfanylidenepyrimidin-5-yl]-[4-methoxy-3-(piperidin-1-ylmethyl)phenyl]methyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(4-chlorophenyl)-5-[[1-(4-chlorophenyl)-6-hydroxy-4-keto-2-thioxo-pyrimidin-5-yl]-[4-methoxy-3-(piperidinomethyl)phenyl]methyl]-6-hydroxy-2-thioxo-pyrimidin-4-one Formula: C34H31Cl2N5O5S2 MolecularWeight: 724.67644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=C(N(C(=S)NC2=O)C3=CC=C(C=C3)Cl)O)C4=C(N(C(=S)NC4=O)C5=CC=C(C=C5)Cl)O)CN6CCCCC6

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=C(N(C(=S)NC2=O)C3=CC=C(C=C3)Cl)O)C4=C(N(C(=S)NC4=O)C5=CC=C(C=C5)Cl)O)CN6CCCCC6

InChI

InChI=1S/C34H31Cl2N5O5S2/c1-46-25-14-5-19(17-20(25)18-39-15-3-2-4-16-39)26(27-29(42)37-33(47)40(31(27)44)23-10-6-21(35)7-11-23)28-30(43)38-34(48)41(32(28)45)24-12-8-22(36)9-13-24/h5-14,17,26,44-45H,2-4,15-16,18H2,1H3,(H,37,42,47)(H,38,43,48)