3-methyl-N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[1-oxo-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]butanamide Traditional Name: 3-methyl-N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]butyramide Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

InChI

InChI=1S/C18H24N4O2S/c1-4-5-16-20-18(22-21-16)25-11-15(23)13-6-8-14(9-7-13)19-17(24)10-12(2)3/h6-9,12H,4-5,10-11H2,1-3H3,(H,19,24)(H,20,21,22)