N-pentan-2-yl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2

Isomeric SMILES

CCCC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2

InChI

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