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

Systemtic Name: ethyl 4-(2-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-hydroxyphenyl)-6-methyl-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-2-thioxo-4H-pyrimidine-5-carboxylate CAS Name: 4-(2-hydroxyphenyl)-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-(2-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-4H-pyrimidine-5-carboxylate Traditional Name: 4-(2-hydroxyphenyl)-6-methyl-1,3-bis(1,2,3,4-tetrahydrocarbazol-9-ylmethyl)-2-thioxo-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C40H42N4O3S MolecularWeight: 658.85148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2O)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=CC=C2O)CN3C4=C(CCCC4)C5=CC=CC=C53)CN6C7=C(CCCC7)C8=CC=CC=C86)C

InChI

InChI=1S/C40H42N4O3S/c1-3-47-39(46)37-26(2)41(24-42-32-19-9-4-14-27(32)28-15-5-10-20-33(28)42)40(48)44(38(37)31-18-8-13-23-36(31)45)25-43-34-21-11-6-16-29(34)30-17-7-12-22-35(30)43/h4,6,8-9,11,13-14,16,18-19,21,23,38,45H,3,5,7,10,12,15,17,20,22,24-25H2,1-2H3