N-(butylcarbamoyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(butylcarbamoyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(butylcarbamoyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-[butylamino(oxo)methyl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(butylcarbamoyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(butylcarbamoyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C13H21N5O2S MolecularWeight: 311.40314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C(C)SC1=NN=CN1C2CC2

Isomeric SMILES

CCCCNC(=O)NC(=O)C(C)SC1=NN=CN1C2CC2

InChI

InChI=1S/C13H21N5O2S/c1-3-4-7-14-12(20)16-11(19)9(2)21-13-17-15-8-18(13)10-5-6-10/h8-10H,3-7H2,1-2H3,(H2,14,16,19,20)