4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[2-[(3-methoxyphenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-keto-2-(m-anisylthio)-6-methyl-1H-pyrimidin-5-yl]acetyl]amino]benzamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O4S/c1-13-18(11-19(27)25-16-8-6-15(7-9-16)20(23)28)21(29)26-22(24-13)31-12-14-4-3-5-17(10-14)30-2/h3-10H,11-12H2,1-2H3,(H2,23,28)(H,25,27)(H,24,26,29)