[4-(benzotriazol-1-ylmethyl)phenyl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: [4-(benzotriazol-1-ylmethyl)phenyl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [4-(benzotriazol-1-ylmethyl)phenyl]-[4-(m-tolylmethyl)piperazin-1-yl]methanone CAS Name: [4-(1-benzotriazolylmethyl)phenyl]-[4-[(3-methylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: [4-(benzotriazol-1-ylmethyl)phenyl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [4-(benzotriazol-1-ylmethyl)phenyl]-[4-(3-methylbenzyl)piperazino]methanone Formula: C26H27N5O MolecularWeight: 425.52548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C26H27N5O/c1-20-5-4-6-22(17-20)18-29-13-15-30(16-14-29)26(32)23-11-9-21(10-12-23)19-31-25-8-3-2-7-24(25)27-28-31/h2-12,17H,13-16,18-19H2,1H3