2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1S)-1-phenylbutyl]ethanamide

Systemtic Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1S)-1-phenylbutyl]ethanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1S)-1-phenylbutyl]acetamide CAS Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-N-[(1S)-1-phenylbutyl]acetamide IUPAC Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1S)-1-phenylbutyl]acetamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[(1S)-1-phenylbutyl]acetamide Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)C

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)C

InChI

InChI=1S/C18H24N4OS/c1-4-9-16(15-10-7-6-8-11-15)19-17(23)13-24-18-21-20-14(3)22(18)12-5-2/h5-8,10-11,16H,2,4,9,12-13H2,1,3H3,(H,19,23)/t16-/m0/s1