2-[2-(benzotriazol-1-yl)ethanoylamino]-N-(4-bromanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoylamino]-N-(4-bromanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-N-(4-bromo-2-methylphenyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]amino]-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C17H16BrN5O2 MolecularWeight: 402.24524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H16BrN5O2/c1-11-8-12(18)6-7-13(11)20-16(24)9-19-17(25)10-23-15-5-3-2-4-14(15)21-22-23/h2-8H,9-10H2,1H3,(H,19,25)(H,20,24)