1-[4-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butyl]-1,2,4-triazole

Systemtic Name: 1-[4-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butyl]-1,2,4-triazole Openeye Name: 1-[4-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butyl]-1,2,4-triazole CAS Name: 1-[4-[(4,5-diphenyl-1H-imidazol-2-yl)thio]butyl]-1,2,4-triazole IUPAC Name: 1-[4-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butyl]-1,2,4-triazole Traditional Name: 1-[4-[(4,5-diphenyl-1H-imidazol-2-yl)thio]butyl]-1,2,4-triazole Formula: C21H21N5S MolecularWeight: 375.48994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N2)SCCCCN3C=NC=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N2)SCCCCN3C=NC=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5S/c1-3-9-17(10-4-1)19-20(18-11-5-2-6-12-18)25-21(24-19)27-14-8-7-13-26-16-22-15-23-26/h1-6,9-12,15-16H,7-8,13-14H2,(H,24,25)