[2-[(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)amino]-2-oxidanylidene-ethyl] 2-oxidanylbenzoate

Systemtic Name: [2-[(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)amino]-2-oxidanylidene-ethyl] 2-oxidanylbenzoate Openeye Name: [2-[(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)amino]-2-oxo-ethyl] 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [2-[(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)amino]-2-oxoethyl] 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [2-keto-2-[(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)amino]ethyl] ester Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)NC(=O)COC(=O)C3=CC=CC=C3O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)NC(=O)COC(=O)C3=CC=CC=C3O)C

InChI

InChI=1S/C17H15N3O5S/c1-9-10(2)26-15-14(9)16(23)20(8-18-15)19-13(22)7-25-17(24)11-5-3-4-6-12(11)21/h3-6,8,21H,7H2,1-2H3,(H,19,22)