N-[2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N-(2,5-dimethylphenyl)thiophene-2-carboxamide

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N-(2,5-dimethylphenyl)thiophene-2-carboxamide Openeye Name: N-[2-(cyclohexylamino)-2-oxo-1-(6-quinolyl)ethyl]-N-(2,5-dimethylphenyl)thiophene-2-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxo-1-(6-quinolinyl)ethyl]-N-(2,5-dimethylphenyl)-2-thiophenecarboxamide IUPAC Name: N-[2-(cyclohexylamino)-2-oxo-1-quinolin-6-ylethyl]-N-(2,5-dimethylphenyl)thiophene-2-carboxamide Traditional Name: N-[2-(cyclohexylamino)-2-keto-1-(6-quinolyl)ethyl]-N-(2,5-dimethylphenyl)thiophene-2-carboxamide Formula: C30H31N3O2S MolecularWeight: 497.65104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C(C2=CC3=C(C=C2)N=CC=C3)C(=O)NC4CCCCC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C(C2=CC3=C(C=C2)N=CC=C3)C(=O)NC4CCCCC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C30H31N3O2S/c1-20-12-13-21(2)26(18-20)33(30(35)27-11-7-17-36-27)28(29(34)32-24-9-4-3-5-10-24)23-14-15-25-22(19-23)8-6-16-31-25/h6-8,11-19,24,28H,3-5,9-10H2,1-2H3,(H,32,34)