4-[(4-bromanyl-2-chloranyl-6-methyl-phenyl)amino]-7-[5-[(2-hydroxyethylamino)methyl]thiophen-2-yl]quinoline-3-carbonitrile

Systemtic Name: 4-[(4-bromanyl-2-chloranyl-6-methyl-phenyl)amino]-7-[5-[(2-hydroxyethylamino)methyl]thiophen-2-yl]quinoline-3-carbonitrile Openeye Name: 4-(4-bromo-2-chloro-6-methyl-anilino)-7-[5-[(2-hydroxyethylamino)methyl]-2-thienyl]quinoline-3-carbonitrile CAS Name: 4-(4-bromo-2-chloro-6-methylanilino)-7-[5-[(2-hydroxyethylamino)methyl]-2-thiophenyl]-3-quinolinecarbonitrile IUPAC Name: 4-(4-bromo-2-chloro-6-methylanilino)-7-[5-[(2-hydroxyethylamino)methyl]thiophen-2-yl]quinoline-3-carbonitrile Traditional Name: 4-(4-bromo-2-chloro-6-methyl-anilino)-7-[5-[(2-hydroxyethylamino)methyl]-2-thienyl]quinoline-3-carbonitrile Formula: C24H20BrClN4OS MolecularWeight: 527.8638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(S4)CNCCO)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(S4)CNCCO)Cl)Br

InChI

InChI=1S/C24H20BrClN4OS/c1-14-8-17(25)10-20(26)23(14)30-24-16(11-27)12-29-21-9-15(2-4-19(21)24)22-5-3-18(32-22)13-28-6-7-31/h2-5,8-10,12,28,31H,6-7,13H2,1H3,(H,29,30)