(E)-N,N'-bis[4-(dimethylamino)-2-methyl-quinolin-6-yl]but-2-enediamide

Systemtic Name: (E)-N,N'-bis[4-(dimethylamino)-2-methyl-quinolin-6-yl]but-2-enediamide Openeye Name: (E)-N,N'-bis[4-(dimethylamino)-2-methyl-6-quinolyl]but-2-enediamide CAS Name: (E)-N,N'-bis[4-(dimethylamino)-2-methyl-6-quinolinyl]-2-butenediamide IUPAC Name: (E)-N,N'-bis[4-(dimethylamino)-2-methylquinolin-6-yl]but-2-enediamide Traditional Name: (E)-N,N'-bis[4-(dimethylamino)-2-methyl-6-quinolyl]but-2-enediamide Formula: C28H30N6O2 MolecularWeight: 482.5768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C=CC(=O)NC3=CC4=C(C=C3)N=C(C=C4N(C)C)C)C(=C1)N(C)C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)/C=C/C(=O)NC3=CC4=C(C=C3)N=C(C=C4N(C)C)C)C(=C1)N(C)C

InChI

InChI=1S/C28H30N6O2/c1-17-13-25(33(3)4)21-15-19(7-9-23(21)29-17)31-27(35)11-12-28(36)32-20-8-10-24-22(16-20)26(34(5)6)14-18(2)30-24/h7-16H,1-6H3,(H,31,35)(H,32,36)/b12-11+