N-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-methoxy-benzamide

Systemtic Name: N-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-methoxy-benzamide Openeye Name: N-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-methoxy-benzamide CAS Name: N-[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-2-methoxybenzamide IUPAC Name: N-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-methoxybenzamide Traditional Name: N-[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetyl]-2-methoxy-benzamide Formula: C12H13N5O3S MolecularWeight: 307.32832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(=O)CSC2=NNC(=N2)N

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C12H13N5O3S/c1-20-8-5-3-2-4-7(8)10(19)14-9(18)6-21-12-15-11(13)16-17-12/h2-5H,6H2,1H3,(H,14,18,19)(H3,13,15,16,17)