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

Systemtic Name: 3-[4-methyl-5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-(benzylamino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C15H19N5O2S MolecularWeight: 333.40866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)CCC(=O)N

InChI

InChI=1S/C15H19N5O2S/c1-20-13(8-7-12(16)21)18-19-15(20)23-10-14(22)17-9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,16,21)(H,17,22)