4-(benzotriazol-1-ylmethyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[4-(isopropylcarbamoylamino)benzyl]benzamide Formula: C25H26N6O2 MolecularWeight: 442.51294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C25H26N6O2/c1-17(2)27-25(33)28-21-13-9-18(10-14-21)15-26-24(32)20-11-7-19(8-12-20)16-31-23-6-4-3-5-22(23)29-30-31/h3-14,17H,15-16H2,1-2H3,(H,26,32)(H2,27,28,33)