2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-ethoxyphenyl)butanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-ethoxyphenyl)butanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-ethoxyphenyl)butanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(4-ethoxyphenyl)butanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-ethoxyphenyl)butanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-p-phenetyl-butyramide Formula: C15H21N5O2S MolecularWeight: 335.42454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OCC)N2C(=NN=C2SC)N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OCC)N2C(=NN=C2SC)N

InChI

InChI=1S/C15H21N5O2S/c1-4-12(20-14(16)18-19-15(20)23-3)13(21)17-10-6-8-11(9-7-10)22-5-2/h6-9,12H,4-5H2,1-3H3,(H2,16,18)(H,17,21)