5-[3-[3-azanyl-1-(methylamino)-2-oxidanylidene-1-(2-prop-2-enoylphenyl)propoxy]-2-methyl-4H-quinolin-1-yl]-N,N-dimethyl-pyridine-2-carboxamide

Systemtic Name: 5-[3-[3-azanyl-1-(methylamino)-2-oxidanylidene-1-(2-prop-2-enoylphenyl)propoxy]-2-methyl-4H-quinolin-1-yl]-N,N-dimethyl-pyridine-2-carboxamide Openeye Name: 5-[3-[3-amino-1-(methylamino)-2-oxo-1-(2-prop-2-enoylphenyl)propoxy]-2-methyl-4H-quinolin-1-yl]-N,N-dimethyl-pyridine-2-carboxamide CAS Name: 5-[3-[3-amino-1-(methylamino)-2-oxo-1-[2-(1-oxoprop-2-enyl)phenyl]propoxy]-2-methyl-4H-quinolin-1-yl]-N,N-dimethyl-2-pyridinecarboxamide IUPAC Name: 5-[3-[3-amino-1-(methylamino)-2-oxo-1-(2-prop-2-enoylphenyl)propoxy]-2-methyl-4H-quinolin-1-yl]-N,N-dimethylpyridine-2-carboxamide Traditional Name: 5-[3-[1-(2-acryloylphenyl)-3-amino-2-keto-1-(methylamino)propoxy]-2-methyl-4H-quinolin-1-yl]-N,N-dimethyl-picolinamide Formula: C31H33N5O4 MolecularWeight: 539.62482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2=CC=CC=C2N1C3=CN=C(C=C3)C(=O)N(C)C)OC(C4=CC=CC=C4C(=O)C=C)(C(=O)CN)NC

Isomeric SMILES

CC1=C(CC2=CC=CC=C2N1C3=CN=C(C=C3)C(=O)N(C)C)OC(C4=CC=CC=C4C(=O)C=C)(C(=O)CN)NC

InChI

InChI=1S/C31H33N5O4/c1-6-27(37)23-12-8-9-13-24(23)31(33-3,29(38)18-32)40-28-17-21-11-7-10-14-26(21)36(20(28)2)22-15-16-25(34-19-22)30(39)35(4)5/h6-16,19,33H,1,17-18,32H2,2-5H3