4-[(2-fluoranyl-4-methyl-phenyl)amino]-6-[1-(2-hydroxyethyl)piperidin-4-yl]-7-methoxy-cinnoline-3-carboxamide

Systemtic Name: 4-[(2-fluoranyl-4-methyl-phenyl)amino]-6-[1-(2-hydroxyethyl)piperidin-4-yl]-7-methoxy-cinnoline-3-carboxamide Openeye Name: 4-(2-fluoro-4-methyl-anilino)-6-[1-(2-hydroxyethyl)-4-piperidyl]-7-methoxy-cinnoline-3-carboxamide CAS Name: 4-(2-fluoro-4-methylanilino)-6-[1-(2-hydroxyethyl)-4-piperidinyl]-7-methoxy-3-cinnolinecarboxamide IUPAC Name: 4-(2-fluoro-4-methylanilino)-6-[1-(2-hydroxyethyl)piperidin-4-yl]-7-methoxycinnoline-3-carboxamide Traditional Name: 4-(2-fluoro-4-methyl-anilino)-6-[1-(2-hydroxyethyl)-4-piperidyl]-7-methoxy-cinnoline-3-carboxamide Formula: C24H28FN5O3 MolecularWeight: 453.509223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(N=NC3=CC(=C(C=C32)C4CCN(CC4)CCO)OC)C(=O)N)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(N=NC3=CC(=C(C=C32)C4CCN(CC4)CCO)OC)C(=O)N)F

InChI

InChI=1S/C24H28FN5O3/c1-14-3-4-19(18(25)11-14)27-22-17-12-16(15-5-7-30(8-6-15)9-10-31)21(33-2)13-20(17)28-29-23(22)24(26)32/h3-4,11-13,15,31H,5-10H2,1-2H3,(H2,26,32)(H,27,28)