4-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-1-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-1-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-1-methyl-2-methylsulfanyl-6-oxo-pyrimidine-5-carbonitrile CAS Name: 4-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-1-methyl-2-(methylthio)-6-oxo-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-1-methyl-2-methylsulfanyl-6-oxopyrimidine-5-carbonitrile Traditional Name: 4-[4-(4-chlorobenzyl)oxy-3-methoxy-phenyl]-6-keto-1-methyl-2-(methylthio)pyrimidine-5-carbonitrile Formula: C21H18ClN3O3S MolecularWeight: 427.90392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1SC)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC)C#N

Isomeric SMILES

CN1C(=O)C(=C(N=C1SC)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC)C#N

InChI

InChI=1S/C21H18ClN3O3S/c1-25-20(26)16(11-23)19(24-21(25)29-3)14-6-9-17(18(10-14)27-2)28-12-13-4-7-15(22)8-5-13/h4-10H,12H2,1-3H3