1-[(3-chloranyl-4-methyl-phenyl)amino]-N-(3-methylcyclohexyl)isoquinoline-4-carboxamide

Systemtic Name: 1-[(3-chloranyl-4-methyl-phenyl)amino]-N-(3-methylcyclohexyl)isoquinoline-4-carboxamide Openeye Name: 1-(3-chloro-4-methyl-anilino)-N-(3-methylcyclohexyl)isoquinoline-4-carboxamide CAS Name: 1-(3-chloro-4-methylanilino)-N-(3-methylcyclohexyl)-4-isoquinolinecarboxamide IUPAC Name: 1-(3-chloro-4-methylanilino)-N-(3-methylcyclohexyl)isoquinoline-4-carboxamide Traditional Name: 1-(3-chloro-4-methyl-anilino)-N-(3-methylcyclohexyl)isoquinoline-4-carboxamide Formula: C24H26ClN3O MolecularWeight: 407.93574

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)C)Cl

Isomeric SMILES

CC1CCCC(C1)NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)C)Cl

InChI

InChI=1S/C24H26ClN3O/c1-15-6-5-7-17(12-15)28-24(29)21-14-26-23(20-9-4-3-8-19(20)21)27-18-11-10-16(2)22(25)13-18/h3-4,8-11,13-15,17H,5-7,12H2,1-2H3,(H,26,27)(H,28,29)