2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[4-[phenyl(propan-2-yl)amino]phenyl]ethanamide

Systemtic Name: 2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[4-[phenyl(propan-2-yl)amino]phenyl]ethanamide Openeye Name: N-[4-(N-isopropylanilino)phenyl]-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: 2-[(6-oxo-1H-pyrimidin-2-yl)thio]-N-[4-(N-propan-2-ylanilino)phenyl]acetamide IUPAC Name: 2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(N-propan-2-ylanilino)phenyl]acetamide Traditional Name: N-[4-(N-isopropylanilino)phenyl]-2-[(6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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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(=O)N3

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2S/c1-15(2)25(17-6-4-3-5-7-17)18-10-8-16(9-11-18)23-20(27)14-28-21-22-13-12-19(26)24-21/h3-13,15H,14H2,1-2H3,(H,23,27)(H,22,24,26)