2-[(5,6-dimethyl-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[(5,6-dimethyl-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[(5,6-dimethyl-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[(5,6-dimethyl-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[(5,6-dimethyl-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[(7-keto-5,6-dimethyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]-N-(3-methoxyphenyl)acetamide Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=NC1=O)NN=C2SCC(=O)NC3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(N2C(=NC1=O)NN=C2SCC(=O)NC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C16H17N5O3S/c1-9-10(2)21-15(18-14(9)23)19-20-16(21)25-8-13(22)17-11-5-4-6-12(7-11)24-3/h4-7H,8H2,1-3H3,(H,17,22)(H,18,19,23)