2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(isobutylcarbamoyl)propanamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(isobutylcarbamoyl)propionamide Formula: C14H25N5O3S MolecularWeight: 343.445

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SC(C)C(=O)NC(=O)NCC(C)C

Isomeric SMILES

CCCCN1C(=O)NN=C1SC(C)C(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C14H25N5O3S/c1-5-6-7-19-13(22)17-18-14(19)23-10(4)11(20)16-12(21)15-8-9(2)3/h9-10H,5-8H2,1-4H3,(H,17,22)(H2,15,16,20,21)