N-[4-[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[2-[(4-ethyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[2-[(4-ethyl-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-3-methyl-butyramide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

Isomeric SMILES

CCN1C=NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

InChI

InChI=1S/C17H22N4O2S/c1-4-21-11-18-20-17(21)24-10-15(22)13-5-7-14(8-6-13)19-16(23)9-12(2)3/h5-8,11-12H,4,9-10H2,1-3H3,(H,19,23)