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

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-prop-2-enylpropanamide IUPAC Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NN=C(N1C2CC2)C3=CC=NC=C3

Isomeric SMILES

CC(C(=O)NCC=C)SC1=NN=C(N1C2CC2)C3=CC=NC=C3

InChI

InChI=1S/C16H19N5OS/c1-3-8-18-15(22)11(2)23-16-20-19-14(21(16)13-4-5-13)12-6-9-17-10-7-12/h3,6-7,9-11,13H,1,4-5,8H2,2H3,(H,18,22)