2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]pyrimidin-4-olate

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]pyrimidin-4-olate Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-[2-oxo-2-(thiazol-2-ylamino)ethyl]pyrimidin-4-olate CAS Name: 2-[(3-methoxyphenyl)methylthio]-6-methyl-5-[2-oxo-2-(2-thiazolylamino)ethyl]-4-pyrimidinolate IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]pyrimidin-4-olate Traditional Name: 5-[2-keto-2-(thiazol-2-ylamino)ethyl]-2-(m-anisylthio)-6-methyl-pyrimidin-4-olate Formula: C18H17N4O3S2- MolecularWeight: 401.48258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC2=CC(=CC=C2)OC)[O-])CC(=O)NC3=NC=CS3

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC2=CC(=CC=C2)OC)[O-])CC(=O)NC3=NC=CS3

InChI

InChI=1S/C18H18N4O3S2/c1-11-14(9-15(23)21-17-19-6-7-26-17)16(24)22-18(20-11)27-10-12-4-3-5-13(8-12)25-2/h3-8H,9-10H2,1-2H3,(H,19,21,23)(H,20,22,24)/p-1