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

Systemtic Name: 4-[[2-chloranyl-4-[3-[(2-hydroxyethylamino)methyl]phenyl]-6-methyl-phenyl]amino]-7-[3-[(2-hydroxyethylamino)methyl]phenyl]quinoline-3-carbonitrile Openeye Name: 4-[2-chloro-4-[3-[(2-hydroxyethylamino)methyl]phenyl]-6-methyl-anilino]-7-[3-[(2-hydroxyethylamino)methyl]phenyl]quinoline-3-carbonitrile CAS Name: 4-[2-chloro-4-[3-[(2-hydroxyethylamino)methyl]phenyl]-6-methylanilino]-7-[3-[(2-hydroxyethylamino)methyl]phenyl]-3-quinolinecarbonitrile IUPAC Name: 4-[2-chloro-4-[3-[(2-hydroxyethylamino)methyl]phenyl]-6-methylanilino]-7-[3-[(2-hydroxyethylamino)methyl]phenyl]quinoline-3-carbonitrile Traditional Name: 4-[2-chloro-4-[3-[(2-hydroxyethylamino)methyl]phenyl]-6-methyl-anilino]-7-[3-[(2-hydroxyethylamino)methyl]phenyl]quinoline-3-carbonitrile Formula: C35H34ClN5O2 MolecularWeight: 592.12976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=CC(=CC=C2)CNCCO)Cl)NC3=C4C=CC(=CC4=NC=C3C#N)C5=CC(=CC=C5)CNCCO

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=CC(=CC=C2)CNCCO)Cl)NC3=C4C=CC(=CC4=NC=C3C#N)C5=CC(=CC=C5)CNCCO

InChI

InChI=1S/C35H34ClN5O2/c1-23-14-29(27-7-3-5-25(16-27)21-39-11-13-43)17-32(36)34(23)41-35-30(19-37)22-40-33-18-28(8-9-31(33)35)26-6-2-4-24(15-26)20-38-10-12-42/h2-9,14-18,22,38-39,42-43H,10-13,20-21H2,1H3,(H,40,41)