N-(2-ethoxyphenyl)-2-[[5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[[5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethoxyphenyl)propanamide CAS Name: N-(2-ethoxyphenyl)-2-[[5-(2-methyl-3-furanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(2-ethoxyphenyl)-2-[[5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[4-allyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]-N-o-phenetyl-propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2CC=C)C3=C(OC=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2CC=C)C3=C(OC=C3)C

InChI

InChI=1S/C21H24N4O3S/c1-5-12-25-19(16-11-13-28-14(16)3)23-24-21(25)29-15(4)20(26)22-17-9-7-8-10-18(17)27-6-2/h5,7-11,13,15H,1,6,12H2,2-4H3,(H,22,26)