4-(benzotriazol-1-ylmethyl)-N-[1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[2-morpholino-1-(p-tolyl)ethyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[1-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[2-morpholino-1-(p-tolyl)ethyl]benzamide Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC=C(C=C1)C(CN2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C27H29N5O2/c1-20-6-10-22(11-7-20)25(19-31-14-16-34-17-15-31)28-27(33)23-12-8-21(9-13-23)18-32-26-5-3-2-4-24(26)29-30-32/h2-13,25H,14-19H2,1H3,(H,28,33)