propan-2-yl 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate

Systemtic Name: propan-2-yl 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate Openeye Name: isopropyl 3-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate CAS Name: 3-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate Traditional Name: 3-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoic acid isopropyl ester Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=CC(=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=CC(=C4)C(=O)OC(C)C

InChI

InChI=1S/C23H21N3O2S/c1-14(2)28-23(27)17-5-4-6-18(11-17)26-21-20-19(12-29-22(20)25-13-24-21)16-9-7-15(3)8-10-16/h4-14H,1-3H3,(H,24,25,26)