2-(3-azanyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(3-azanyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-(3-amino-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-acetic acid CAS Name: 2-[(3-amino-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-2-phenylacetic acid IUPAC Name: 2-(3-amino-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[(3-amino-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-2-phenyl-acetic acid Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C3=CC=CC=C3)C(=O)O)N)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C3=CC=CC=C3)C(=O)O)N)C

InChI

InChI=1S/C16H15N3O3S2/c1-8-9(2)23-13-11(8)14(20)19(17)16(18-13)24-12(15(21)22)10-6-4-3-5-7-10/h3-7,12H,17H2,1-2H3,(H,21,22)