ethyl 4-(3-methoxy-4-oxidanyl-phenyl)-6-methyl-2-sulfanylidene-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3-methoxy-4-oxidanyl-phenyl)-6-methyl-2-sulfanylidene-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-hydroxy-3-methoxy-phenyl)-6-methyl-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-2-thioxo-4H-pyrimidine-5-carboxylate CAS Name: 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-4H-pyrimidine-5-carboxylate Traditional Name: 4-(4-hydroxy-3-methoxy-phenyl)-6-methyl-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-2-thioxo-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C41H44N4O4S MolecularWeight: 688.87746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC(=C(C=C2)O)OC)CN3C4=C(CCCC4)C5=CC=CC=C53)CN6C7=C(CCCC7)C8=CC=CC=C86)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC(=C(C=C2)O)OC)CN3C4=C(CCCC4)C5=CC=CC=C53)CN6C7=C(CCCC7)C8=CC=CC=C86)C

InChI

InChI=1S/C41H44N4O4S/c1-4-49-40(47)38-26(2)42(24-43-32-17-9-5-13-28(32)29-14-6-10-18-33(29)43)41(50)45(39(38)27-21-22-36(46)37(23-27)48-3)25-44-34-19-11-7-15-30(34)31-16-8-12-20-35(31)44/h5,7,9,11,13,15,17,19,21-23,39,46H,4,6,8,10,12,14,16,18,20,24-25H2,1-3H3