N-[4-(3-methylbutanoylamino)phenyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-2H-benzotriazole-5-carboxamide Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=NNN=C3C=C2

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=NNN=C3C=C2

InChI

InChI=1S/C18H19N5O2/c1-11(2)9-17(24)19-13-4-6-14(7-5-13)20-18(25)12-3-8-15-16(10-12)22-23-21-15/h3-8,10-11H,9H2,1-2H3,(H,19,24)(H,20,25)(H,21,22,23)