N-[(1R)-2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N-[(4-methoxyphenyl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[(1R)-2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N-[(4-methoxyphenyl)methyl]thiophene-2-carboxamide Openeye Name: N-[(1R)-2-(cyclohexylamino)-2-oxo-1-(6-quinolyl)ethyl]-N-[(4-methoxyphenyl)methyl]thiophene-2-carboxamide CAS Name: N-[(1R)-2-(cyclohexylamino)-2-oxo-1-(6-quinolinyl)ethyl]-N-[(4-methoxyphenyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-[(1R)-2-(cyclohexylamino)-2-oxo-1-quinolin-6-ylethyl]-N-[(4-methoxyphenyl)methyl]thiophene-2-carboxamide Traditional Name: N-[(1R)-2-(cyclohexylamino)-2-keto-1-(6-quinolyl)ethyl]-N-p-anisyl-thiophene-2-carboxamide Formula: C30H31N3O3S MolecularWeight: 513.65044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C(C2=CC3=C(C=C2)N=CC=C3)C(=O)NC4CCCCC4)C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)CN([C@H](C2=CC3=C(C=C2)N=CC=C3)C(=O)NC4CCCCC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C30H31N3O3S/c1-36-25-14-11-21(12-15-25)20-33(30(35)27-10-6-18-37-27)28(29(34)32-24-8-3-2-4-9-24)23-13-16-26-22(19-23)7-5-17-31-26/h5-7,10-19,24,28H,2-4,8-9,20H2,1H3,(H,32,34)/t28-/m1/s1