N-cyclopropyl-2-[[5-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cyclopropyl-2-[[5-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-propanamide CAS Name: N-cyclopropyl-2-[[5-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cyclopropyl-2-[[5-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[4-allyl-5-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-propionamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)SC2=NN=C(N2CC=C)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC(C(=O)NC1CC1)SC2=NN=C(N2CC=C)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H22N4O3S/c1-3-10-23-17(16-11-25-14-6-4-5-7-15(14)26-16)21-22-19(23)27-12(2)18(24)20-13-8-9-13/h3-7,12-13,16H,1,8-11H2,2H3,(H,20,24)