ethyl 5-[2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl]-2-methylsulfanyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl]-2-methylsulfanyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-[2-(3-hydroxyanilino)pyrimidin-4-yl]-2-methylsulfanyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-[2-(3-hydroxyanilino)-4-pyrimidinyl]-2-(methylthio)-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(3-hydroxyanilino)pyrimidin-4-yl]-2-methylsulfanyl-4-phenylthiophene-3-carboxylate Traditional Name: 5-[2-(3-hydroxyanilino)pyrimidin-4-yl]-2-(methylthio)-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)O)SC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)O)SC

InChI

InChI=1S/C24H21N3O3S2/c1-3-30-22(29)20-19(15-8-5-4-6-9-15)21(32-23(20)31-2)18-12-13-25-24(27-18)26-16-10-7-11-17(28)14-16/h4-14,28H,3H2,1-2H3,(H,25,26,27)