N'-[2,5-dimethoxy-4-(thiophen-2-ylcarbonylamino)phenyl]-N-quinolin-5-yl-butanediamide hydrochloride

Systemtic Name: N'-[2,5-dimethoxy-4-(thiophen-2-ylcarbonylamino)phenyl]-N-quinolin-5-yl-butanediamide hydrochloride Openeye Name: N'-[2,5-dimethoxy-4-(thiophene-2-carbonylamino)phenyl]-N-(5-quinolyl)butanediamide hydrochloride CAS Name: N'-[2,5-dimethoxy-4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-N-(5-quinolinyl)butanediamide hydrochloride IUPAC Name: N'-[2,5-dimethoxy-4-(thiophene-2-carbonylamino)phenyl]-N-quinolin-5-ylbutanediamide hydrochloride Traditional Name: N'-[2,5-dimethoxy-4-(2-thenoylamino)phenyl]-N-(5-quinolyl)succinamide hydrochloride Formula: C26H25ClN4O5S MolecularWeight: 541.0185

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OC)NC(=O)CCC(=O)NC3=CC=CC4=C3C=CC=N4.Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OC)NC(=O)CCC(=O)NC3=CC=CC4=C3C=CC=N4.Cl

InChI

InChI=1S/C26H24N4O5S.ClH/c1-34-21-15-20(30-26(33)23-9-5-13-36-23)22(35-2)14-19(21)29-25(32)11-10-24(31)28-18-8-3-7-17-16(18)6-4-12-27-17;/h3-9,12-15H,10-11H2,1-2H3,(H,28,31)(H,29,32)(H,30,33);1H