2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: N-(isobutylcarbamoyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: N-(isobutylcarbamoyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SC(C)C(=O)NC(=O)NCC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SC(C)C(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C17H23N5O2S/c1-11(2)9-18-16(24)20-15(23)13(4)25-17-21-19-10-22(17)14-8-6-5-7-12(14)3/h5-8,10-11,13H,9H2,1-4H3,(H2,18,20,23,24)