4-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[[4-allyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-isobutyl-benzamide CAS Name: 4-[[[5-(2-furanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-[[[4-allyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]-N-isobutyl-benzamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=CC=CO3

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=CC=CO3

InChI

InChI=1S/C21H24N4O2S/c1-4-11-25-19(18-6-5-12-27-18)23-24-21(25)28-14-16-7-9-17(10-8-16)20(26)22-13-15(2)3/h4-10,12,15H,1,11,13-14H2,2-3H3,(H,22,26)