[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-thiophen-2-ylethanoate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-thiophen-2-ylethanoate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)CC3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)CC3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O2S/c1-16-24-21(17-6-3-2-4-7-17)15-22(25-16)26-18-9-11-19(12-10-18)28-23(27)14-20-8-5-13-29-20/h2-13,15H,14H2,1H3,(H,24,25,26)