(2R)-N-aminocarbonyl-2-[[5-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-methyl-butanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[[5-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-methyl-butanamide Openeye Name: (2R)-N-carbamoyl-2-[[5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-methyl-butanamide CAS Name: (2R)-N-carbamoyl-2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-3-methylbutanamide IUPAC Name: (2R)-N-carbamoyl-2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-3-methylbutanamide Traditional Name: (2R)-N-carbamoyl-2-[[5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]thio]-3-methyl-butyramide Formula: C15H18ClN5O3S MolecularWeight: 383.85312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NNC(=N1)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)SC1=NNC(=N1)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C15H18ClN5O3S/c1-7(2)11(13(22)19-14(17)23)25-15-18-12(20-21-15)9-6-8(16)4-5-10(9)24-3/h4-7,11H,1-3H3,(H,18,20,21)(H3,17,19,22,23)/t11-/m1/s1