N-[1-(cyclohexylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]benzotriazole-1-carboxamide

Systemtic Name: N-[1-(cyclohexylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]benzotriazole-1-carboxamide Openeye Name: N-[1-benzyl-2-(cyclohexylamino)-2-oxo-ethyl]benzotriazole-1-carboxamide CAS Name: N-[1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]-1-benzotriazolecarboxamide IUPAC Name: N-[1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]benzotriazole-1-carboxamide Traditional Name: N-[1-benzyl-2-(cyclohexylamino)-2-keto-ethyl]benzotriazole-1-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCC(CC1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H25N5O2/c28-21(23-17-11-5-2-6-12-17)19(15-16-9-3-1-4-10-16)24-22(29)27-20-14-8-7-13-18(20)25-26-27/h1,3-4,7-10,13-14,17,19H,2,5-6,11-12,15H2,(H,23,28)(H,24,29)