O2-tert-butyl O4-ethyl 5-[[2-(4-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-[[2-(4-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[2-(4-chlorophenyl)-3-methyl-4-quinolinyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-[[2-(4-chlorophenyl)-3-methylquinoline-4-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C30H29ClN2O5S MolecularWeight: 565.07966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C30H29ClN2O5S/c1-7-37-28(35)23-17(3)25(29(36)38-30(4,5)6)39-27(23)33-26(34)22-16(2)24(18-12-14-19(31)15-13-18)32-21-11-9-8-10-20(21)22/h8-15H,7H2,1-6H3,(H,33,34)