N-[4-[phenyl(propan-2-yl)amino]phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-[phenyl(propan-2-yl)amino]phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(N-isopropylanilino)phenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[4-(N-propan-2-ylanilino)phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[4-(N-propan-2-ylanilino)phenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[4-(N-isopropylanilino)phenyl]-2-(2-pyrimidylthio)acetamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C21H22N4OS/c1-16(2)25(18-7-4-3-5-8-18)19-11-9-17(10-12-19)24-20(26)15-27-21-22-13-6-14-23-21/h3-14,16H,15H2,1-2H3,(H,24,26)