2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide

Systemtic Name: 2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide Openeye Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-propyl-propanamide CAS Name: 2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-propylpropanamide IUPAC Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylpropanamide Traditional Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-propyl-propionamide Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NN=C(N1CC2=CC=CC=C2)C3CC3

Isomeric SMILES

CCCNC(=O)C(C)SC1=NN=C(N1CC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C18H24N4OS/c1-3-11-19-17(23)13(2)24-18-21-20-16(15-9-10-15)22(18)12-14-7-5-4-6-8-14/h4-8,13,15H,3,9-12H2,1-2H3,(H,19,23)