methyl 2-[4-oxidanylidene-2-[[4-(phenylcarbamoyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[[4-(phenylcarbamoyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[[4-(phenylcarbamoyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[4-[anilino(oxo)methyl]phenyl]methylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[[4-(phenylcarbamoyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[4-(phenylcarbamoyl)benzyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4S/c1-28-19(26)12-17-11-18(25)24-21(23-17)29-13-14-7-9-15(10-8-14)20(27)22-16-5-3-2-4-6-16/h2-11H,12-13H2,1H3,(H,22,27)(H,23,24,25)