1-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-(4-morpholin-4-ylphenyl)cyclopentane-1-carboxamide

Systemtic Name: 1-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-(4-morpholin-4-ylphenyl)cyclopentane-1-carboxamide Openeye Name: 1-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-(4-morpholinophenyl)cyclopentanecarboxamide CAS Name: 1-[[2-(1-benzotriazolyl)-1-oxoethyl]-(phenylmethyl)amino]-N-[4-(4-morpholinyl)phenyl]-1-cyclopentanecarboxamide IUPAC Name: 1-[[2-(benzotriazol-1-yl)acetyl]-benzylamino]-N-(4-morpholin-4-ylphenyl)cyclopentane-1-carboxamide Traditional Name: 1-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-(4-morpholinophenyl)cyclopentanecarboxamide Formula: C31H34N6O3 MolecularWeight: 538.64006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NC2=CC=C(C=C2)N3CCOCC3)N(CC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1CCC(C1)(C(=O)NC2=CC=C(C=C2)N3CCOCC3)N(CC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C31H34N6O3/c38-29(23-37-28-11-5-4-10-27(28)33-34-37)36(22-24-8-2-1-3-9-24)31(16-6-7-17-31)30(39)32-25-12-14-26(15-13-25)35-18-20-40-21-19-35/h1-5,8-15H,6-7,16-23H2,(H,32,39)