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

Systemtic Name: 3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: 3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C9H14N4OS MolecularWeight: 226.29866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCCC(=O)N

Isomeric SMILES

CC1=NN=C(N1CC=C)SCCC(=O)N

InChI

InChI=1S/C9H14N4OS/c1-3-5-13-7(2)11-12-9(13)15-6-4-8(10)14/h3H,1,4-6H2,2H3,(H2,10,14)