N-(1,3-benzodioxol-5-yl)-3-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=NC=C5

Isomeric SMILES

C1CC1N2C(=NN=C2SCCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=NC=C5

InChI

InChI=1S/C20H19N5O3S/c26-18(22-14-1-4-16-17(11-14)28-12-27-16)7-10-29-20-24-23-19(25(20)15-2-3-15)13-5-8-21-9-6-13/h1,4-6,8-9,11,15H,2-3,7,10,12H2,(H,22,26)