3-heptadecyl-4-(phenylmethyl)-5-[(phenylmethyl)disulfanyl]-1,2,4-triazole

Systemtic Name: 3-heptadecyl-4-(phenylmethyl)-5-[(phenylmethyl)disulfanyl]-1,2,4-triazole Openeye Name: 4-benzyl-3-(benzyldisulfanyl)-5-heptadecyl-1,2,4-triazole CAS Name: 3-heptadecyl-4-(phenylmethyl)-5-[(phenylmethyl)disulfanyl]-1,2,4-triazole IUPAC Name: 4-benzyl-3-(benzyldisulfanyl)-5-heptadecyl-1,2,4-triazole Traditional Name: 4-benzyl-3-(benzyldisulfanyl)-5-heptadecyl-1,2,4-triazole Formula: C33H49N3S2 MolecularWeight: 551.89226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NN=C(N1CC2=CC=CC=C2)SSCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NN=C(N1CC2=CC=CC=C2)SSCC3=CC=CC=C3

InChI

InChI=1S/C33H49N3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-32-34-35-33(36(32)28-30-23-18-16-19-24-30)38-37-29-31-25-20-17-21-26-31/h16-21,23-26H,2-15,22,27-29H2,1H3