N-(3-methoxyphenyl)-1-methyl-6-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-methoxyphenyl)-1-methyl-6-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-pyrimidine-5-carboxamide Openeye Name: 2-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-N-(3-methoxyphenyl)-1-methyl-6-oxo-pyrimidine-5-carboxamide CAS Name: N-(3-methoxyphenyl)-1-methyl-6-oxo-2-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-5-pyrimidinecarboxamide IUPAC Name: 2-[2-(benzylamino)-2-oxoethyl]sulfanyl-N-(3-methoxyphenyl)-1-methyl-6-oxopyrimidine-5-carboxamide Traditional Name: 2-[[2-(benzylamino)-2-keto-ethyl]thio]-6-keto-N-(3-methoxyphenyl)-1-methyl-pyrimidine-5-carboxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN=C1SCC(=O)NCC2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CN1C(=O)C(=CN=C1SCC(=O)NCC2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

InChI

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