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

Systemtic Name: N-[4-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]acetamide CAS Name: N-[4-[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]acetamide IUPAC Name: N-[4-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]acetamide Traditional Name: N-[4-[2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]acetamide Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C12H13N5O2S/c1-7(18)14-9-4-2-8(3-5-9)10(19)6-20-12-15-11(13)16-17-12/h2-5H,6H2,1H3,(H,14,18)(H3,13,15,16,17)