1-[4-(phenylmethyl)-5-(phenylmethyl)sulfonyl-1,2,4-triazol-3-yl]butan-1-amine

Systemtic Name: 1-[4-(phenylmethyl)-5-(phenylmethyl)sulfonyl-1,2,4-triazol-3-yl]butan-1-amine Openeye Name: 1-(4-benzyl-5-benzylsulfonyl-1,2,4-triazol-3-yl)butan-1-amine CAS Name: 1-[4-(phenylmethyl)-5-(phenylmethyl)sulfonyl-1,2,4-triazol-3-yl]-1-butanamine IUPAC Name: 1-(4-benzyl-5-benzylsulfonyl-1,2,4-triazol-3-yl)butan-1-amine Traditional Name: 1-(4-benzyl-5-benzylsulfonyl-1,2,4-triazol-3-yl)butylamine Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NN=C(N1CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3)N

Isomeric SMILES

CCCC(C1=NN=C(N1CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C20H24N4O2S/c1-2-9-18(21)19-22-23-20(24(19)14-16-10-5-3-6-11-16)27(25,26)15-17-12-7-4-8-13-17/h3-8,10-13,18H,2,9,14-15,21H2,1H3