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

Systemtic Name: 3-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-N-(3-chloranyl-4-methyl-phenyl)propanamide Openeye Name: 3-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-N-(3-chloro-4-methyl-phenyl)propanamide CAS Name: 3-[5-[(2-amino-2-oxoethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]-N-(3-chloro-4-methylphenyl)propanamide IUPAC Name: 3-[5-(2-amino-2-oxoethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-N-(3-chloro-4-methylphenyl)propanamide Traditional Name: 3-[5-[(2-amino-2-keto-ethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]-N-(3-chloro-4-methyl-phenyl)propionamide Formula: C16H20ClN5O2S MolecularWeight: 381.8803

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N)CCC(=O)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N)CCC(=O)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C16H20ClN5O2S/c1-3-22-14(20-21-16(22)25-9-13(18)23)6-7-15(24)19-11-5-4-10(2)12(17)8-11/h4-5,8H,3,6-7,9H2,1-2H3,(H2,18,23)(H,19,24)