2-(benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-N-quinolin-3-yl-propanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-N-quinolin-3-yl-propanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxo-ethyl]-N-(3-quinolyl)propanamide CAS Name: 2-(1-benzotriazolyl)-N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(3-quinolinyl)propanamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-quinolin-3-ylpropanamide Traditional Name: 2-(benzotriazol-1-yl)-N-[2-(cyclohexylamino)-2-keto-1-(4-methoxyphenyl)ethyl]-N-(3-quinolyl)propionamide Formula: C33H34N6O3 MolecularWeight: 562.66146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC2=CC=CC=C2N=C1)C(C3=CC=C(C=C3)OC)C(=O)NC4CCCCC4)N5C6=CC=CC=C6N=N5

Isomeric SMILES

CC(C(=O)N(C1=CC2=CC=CC=C2N=C1)C(C3=CC=C(C=C3)OC)C(=O)NC4CCCCC4)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C33H34N6O3/c1-22(39-30-15-9-8-14-29(30)36-37-39)33(41)38(26-20-24-10-6-7-13-28(24)34-21-26)31(23-16-18-27(42-2)19-17-23)32(40)35-25-11-4-3-5-12-25/h6-10,13-22,25,31H,3-5,11-12H2,1-2H3,(H,35,40)