[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] thiophene-2-carboxylate

Systemtic Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] thiophene-2-carboxylate Openeye Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C21H15N3O2S MolecularWeight: 373.4277

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(=O)C4=CC=CS4

InChI

InChI=1S/C21H15N3O2S/c25-21(19-7-4-12-27-19)26-17-10-8-16(9-11-17)24-20-13-18(22-14-23-20)15-5-2-1-3-6-15/h1-14H,(H,22,23,24)