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

Systemtic Name: N-aminocarbonyl-3-methyl-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: N-carbamoyl-3-methyl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N-carbamoyl-3-methyl-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: N-carbamoyl-3-methyl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]butyramide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SC(C(C)C)C(=O)NC(=O)N)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SC(C(C)C)C(=O)NC(=O)N)C

InChI

InChI=1S/C16H21N5O2S/c1-9(2)13(14(22)18-15(17)23)24-16-20-19-11(4)21(16)12-7-5-6-10(3)8-12/h5-9,13H,1-4H3,(H3,17,18,22,23)