methyl 4-[(5-methyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(5-methyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(5-methyl-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate CAS Name: 4-[[(5-methyl-4-oxo-3-phenethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-methyl-4-oxo-3-phenethylthieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate Traditional Name: 4-[(4-keto-5-methyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoic acid methyl ester Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C24H21N3O4S/c1-15-19-22(25-14-27(23(19)29)13-12-16-6-4-3-5-7-16)32-20(15)21(28)26-18-10-8-17(9-11-18)24(30)31-2/h3-11,14H,12-13H2,1-2H3,(H,26,28)