4-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropyl-butanamide

Systemtic Name: 4-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropyl-butanamide Openeye Name: 4-[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropyl-butanamide CAS Name: 4-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N,N-dipropylbutanamide IUPAC Name: 4-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropylbutanamide Traditional Name: 4-[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]thio]-N,N-dipropyl-butyramide Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CCCSC1=NN=C(N1C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCCN(CCC)C(=O)CCCSC1=NN=C(N1C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H34N4OS/c1-5-17-29(18-6-2)24(31)8-7-19-32-26-28-27-25(22-13-9-20(3)10-14-22)30(26)23-15-11-21(4)12-16-23/h9-16H,5-8,17-19H2,1-4H3