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

Systemtic Name: (2R)-2-[[5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: (2R)-2-[[4-allyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: (2R)-2-[[5-(2-methyl-3-furanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: (2R)-2-[[5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: (2R)-2-[[4-allyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2CC=C)SC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2CC=C)S[C@H](C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C18H18N4O2S/c1-3-10-22-17(14-9-11-24-12(14)2)20-21-18(22)25-15(16(19)23)13-7-5-4-6-8-13/h3-9,11,15H,1,10H2,2H3,(H2,19,23)/t15-/m1/s1