2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C13H22N6O2S MolecularWeight: 326.41778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NN=C(N1N)C2CC2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NN=C(N1N)C2CC2

InChI

InChI=1S/C13H22N6O2S/c1-8(2)5-6-15-12(21)16-10(20)7-22-13-18-17-11(19(13)14)9-3-4-9/h8-9H,3-7,14H2,1-2H3,(H2,15,16,20,21)