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

Systemtic Name: N-aminocarbonyl-3-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N-carbamoyl-3-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: N-carbamoyl-3-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-carbamoyl-3-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]butyramide Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O2S/c1-8(2)10(12(20)17-13(15)21)22-14-16-11(18-19-14)9-6-4-3-5-7-9/h3-8,10H,1-2H3,(H,16,18,19)(H3,15,17,20,21)