2-methylpropyl 4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate

Systemtic Name: 2-methylpropyl 4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: isobutyl 4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 4-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid isobutyl ester Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)C(=O)OCC(C)C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)C(=O)OCC(C)C)C

InChI

InChI=1S/C19H21N3O2S/c1-11(2)9-24-19(23)14-5-7-15(8-6-14)22-17-16-12(3)13(4)25-18(16)21-10-20-17/h5-8,10-11H,9H2,1-4H3,(H,20,21,22)