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

Systemtic Name: 3-[4-methyl-5-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[[2-oxo-2-(prop-2-ynylamino)ethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-keto-2-(propargylamino)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C11H15N5O2S MolecularWeight: 281.3341

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NCC#C)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NCC#C)CCC(=O)N

InChI

InChI=1S/C11H15N5O2S/c1-3-6-13-10(18)7-19-11-15-14-9(16(11)2)5-4-8(12)17/h1H,4-7H2,2H3,(H2,12,17)(H,13,18)