N-(3-methoxyphenyl)-2-[(4-oxidanyl-6-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-methoxyphenyl)-2-[(4-oxidanyl-6-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-allyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[(4-hydroxy-6-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[(4-hydroxy-6-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[(5-allyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-(3-methoxyphenyl)acetamide Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=NC(=C(C(=O)N2)CC=C)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=NC(=C(C(=O)N2)CC=C)O

InChI

InChI=1S/C16H17N3O4S/c1-3-5-12-14(21)18-16(19-15(12)22)24-9-13(20)17-10-6-4-7-11(8-10)23-2/h3-4,6-8H,1,5,9H2,2H3,(H,17,20)(H2,18,19,21,22)