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

Systemtic Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: 3-[[5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylpropanamide Traditional Name: 3-[[4-allyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=C2

Isomeric SMILES

COCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H20N4O2S/c1-3-10-20-14(12-22-2)18-19-16(20)23-11-9-15(21)17-13-7-5-4-6-8-13/h3-8H,1,9-12H2,2H3,(H,17,21)