propyl 4-[(2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]benzoate

Systemtic Name: propyl 4-[(2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]benzoate Openeye Name: propyl 4-[(2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate CAS Name: 4-[[(2-cyclopropyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-cyclopropyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate Traditional Name: 4-[(2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoic acid propyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C4CC4)C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C4CC4)C)C

InChI

InChI=1S/C22H23N3O3S/c1-4-11-28-22(27)15-7-9-16(10-8-15)24-20(26)18-12(2)17-13(3)23-19(14-5-6-14)25-21(17)29-18/h7-10,14H,4-6,11H2,1-3H3,(H,24,26)