N-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-(4-ethylphenoxy)propanamide

Systemtic Name: N-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-(4-ethylphenoxy)propanamide Openeye Name: N-[[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-(4-ethylphenoxy)propanamide CAS Name: N-[[5-[(2-amino-2-oxoethyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-(4-ethylphenoxy)propanamide IUPAC Name: N-[[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-(4-ethylphenoxy)propanamide Traditional Name: N-[[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-(4-ethylphenoxy)propionamide Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(C)C(=O)NCC2=NN=C(N2C)SCC(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)OC(C)C(=O)NCC2=NN=C(N2C)SCC(=O)N

InChI

InChI=1S/C17H23N5O3S/c1-4-12-5-7-13(8-6-12)25-11(2)16(24)19-9-15-20-21-17(22(15)3)26-10-14(18)23/h5-8,11H,4,9-10H2,1-3H3,(H2,18,23)(H,19,24)