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

Systemtic Name: ethyl 2-[(5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]benzoate Openeye Name: ethyl 2-[(5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate CAS Name: 2-[[(5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate Traditional Name: 2-[(4-keto-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3C(=O)OCC)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3C(=O)OCC)C

InChI

InChI=1S/C20H21N3O4S/c1-4-10-23-11-21-18-15(19(23)25)12(3)16(28-18)17(24)22-14-9-7-6-8-13(14)20(26)27-5-2/h6-9,11H,4-5,10H2,1-3H3,(H,22,24)