5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dipropyl-pentanamide

Systemtic Name: 5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dipropyl-pentanamide Openeye Name: 5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dipropyl-pentanamide CAS Name: 5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N,N-dipropylpentanamide IUPAC Name: 5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dipropylpentanamide Traditional Name: 5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N,N-dipropyl-valeramide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CCCCSC1=NN=C(N1C2=CC=CC=C2)C

Isomeric SMILES

CCCN(CCC)C(=O)CCCCSC1=NN=C(N1C2=CC=CC=C2)C

InChI

InChI=1S/C20H30N4OS/c1-4-14-23(15-5-2)19(25)13-9-10-16-26-20-22-21-17(3)24(20)18-11-7-6-8-12-18/h6-8,11-12H,4-5,9-10,13-16H2,1-3H3