N1,N4-bis(benzotriazol-1-ylmethyl)-N1,N4-bis[(2S)-butan-2-yl]benzene-1,4-diamine

Systemtic Name: N1,N4-bis(benzotriazol-1-ylmethyl)-N1,N4-bis[(2S)-butan-2-yl]benzene-1,4-diamine Openeye Name: N1,N4-bis(benzotriazol-1-ylmethyl)-N1,N4-bis[(1S)-1-methylpropyl]benzene-1,4-diamine CAS Name: N1,N4-bis(1-benzotriazolylmethyl)-N1,N4-bis[(2S)-butan-2-yl]benzene-1,4-diamine IUPAC Name: 1-N,4-N-bis(benzotriazol-1-ylmethyl)-1-N,4-N-bis[(2S)-butan-2-yl]benzene-1,4-diamine Traditional Name: benzotriazol-1-ylmethyl-[4-[benzotriazol-1-ylmethyl-[(1S)-1-methylpropyl]amino]phenyl]-[(1S)-1-methylpropyl]amine Formula: C28H34N8 MolecularWeight: 482.62316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CN1C2=CC=CC=C2N=N1)C3=CC=C(C=C3)N(CN4C5=CC=CC=C5N=N4)C(C)CC

Isomeric SMILES

CC[C@H](C)N(CN1C2=CC=CC=C2N=N1)C3=CC=C(C=C3)N(CN4C5=CC=CC=C5N=N4)[C@@H](C)CC

InChI

InChI=1S/C28H34N8/c1-5-21(3)33(19-35-27-13-9-7-11-25(27)29-31-35)23-15-17-24(18-16-23)34(22(4)6-2)20-36-28-14-10-8-12-26(28)30-32-36/h7-18,21-22H,5-6,19-20H2,1-4H3/t21-,22-/m0/s1