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

Systemtic Name: 2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-propan-2-yloxyphenyl)ethanamide Openeye Name: N-(4-isopropoxyphenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]-N-(4-propan-2-yloxyphenyl)acetamide IUPAC Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-propan-2-yloxyphenyl)acetamide Traditional Name: N-(4-isopropoxyphenyl)-2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-14(2)27-17-10-8-16(9-11-17)22-20(26)13-28-21-23-18(12-19(25)24-21)15-6-4-3-5-7-15/h3-12,14H,13H2,1-2H3,(H,22,26)(H,23,24,25)