3-[6-aminocarbonyl-5-methyl-2-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: 3-[6-aminocarbonyl-5-methyl-2-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[6-carbamoyl-5-methyl-2-(m-tolyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[6-carbamoyl-5-methyl-2-(3-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[6-carbamoyl-5-methyl-2-(3-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[6-carbamoyl-4-keto-5-methyl-2-(m-tolyl)thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C18H16N3O4S- MolecularWeight: 370.40234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(C(=C(S3)C(=O)N)C)C(=O)N2CCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(C(=C(S3)C(=O)N)C)C(=O)N2CCC(=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c1-9-4-3-5-11(8-9)16-20-17-13(10(2)14(26-17)15(19)24)18(25)21(16)7-6-12(22)23/h3-5,8H,6-7H2,1-2H3,(H2,19,24)(H,22,23)/p-1