4-[3-(4-chloranylphenoxy)phenyl]-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-[3-(4-chloranylphenoxy)phenyl]-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-[3-(4-chlorophenoxy)phenyl]-6-methyl-N-(5-methylisoxazol-3-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-[3-(4-chlorophenoxy)phenyl]-6-methyl-N-(5-methyl-3-isoxazolyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-[3-(4-chlorophenoxy)phenyl]-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-[3-(4-chlorophenoxy)phenyl]-6-methyl-N-(5-methylisoxazol-3-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C22H19ClN4O3S MolecularWeight: 454.92926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=C(NC(=S)NC2C3=CC(=CC=C3)OC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=C(NC(=S)NC2C3=CC(=CC=C3)OC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H19ClN4O3S/c1-12-10-18(27-30-12)25-21(28)19-13(2)24-22(31)26-20(19)14-4-3-5-17(11-14)29-16-8-6-15(23)7-9-16/h3-11,20H,1-2H3,(H2,24,26,31)(H,25,27,28)