N-(4-methoxyphenyl)-2-[6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)-1-prop-2-enyl-pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-[6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)-1-prop-2-enyl-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(1-allyl-5-benzyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[6-hydroxy-4-oxo-5-(phenylmethyl)-1-prop-2-enyl-2-pyrimidinyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-(5-benzyl-6-hydroxy-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(1-allyl-5-benzyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]-N-(4-methoxyphenyl)acetamide Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2CC=C)O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2CC=C)O)CC3=CC=CC=C3

InChI

InChI=1S/C23H23N3O4S/c1-3-13-26-22(29)19(14-16-7-5-4-6-8-16)21(28)25-23(26)31-15-20(27)24-17-9-11-18(30-2)12-10-17/h3-12,29H,1,13-15H2,2H3,(H,24,27)