3-[(6-methoxycarbonyl-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]-4-methyl-benzoate

Systemtic Name: 3-[(6-methoxycarbonyl-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]-4-methyl-benzoate Openeye Name: 3-[(6-methoxycarbonyl-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]-4-methyl-benzoate CAS Name: 3-[(6-methoxycarbonyl-2,5-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]-4-methylbenzoate IUPAC Name: 3-[(6-methoxycarbonyl-2,5-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-methylbenzoate Traditional Name: 3-[(6-carbomethoxy-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]-4-methyl-benzoate Formula: C18H16N3O4S- MolecularWeight: 370.40234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC2=C3C(=C(SC3=NC(=N2)C)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC2=C3C(=C(SC3=NC(=N2)C)C(=O)OC)C

InChI

InChI=1S/C18H17N3O4S/c1-8-5-6-11(17(22)23)7-12(8)21-15-13-9(2)14(18(24)25-4)26-16(13)20-10(3)19-15/h5-7H,1-4H3,(H,22,23)(H,19,20,21)/p-1