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

Systemtic Name: 1-[(3-chloranyl-4-methyl-phenyl)amino]-N-(3-morpholin-4-ylpropyl)isoquinoline-4-carboxamide Openeye Name: 1-(3-chloro-4-methyl-anilino)-N-(3-morpholinopropyl)isoquinoline-4-carboxamide CAS Name: 1-(3-chloro-4-methylanilino)-N-[3-(4-morpholinyl)propyl]-4-isoquinolinecarboxamide IUPAC Name: 1-(3-chloro-4-methylanilino)-N-(3-morpholin-4-ylpropyl)isoquinoline-4-carboxamide Traditional Name: 1-(3-chloro-4-methyl-anilino)-N-(3-morpholinopropyl)isoquinoline-4-carboxamide Formula: C24H27ClN4O2 MolecularWeight: 438.94978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C(=O)NCCCN4CCOCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C(=O)NCCCN4CCOCC4)Cl

InChI

InChI=1S/C24H27ClN4O2/c1-17-7-8-18(15-22(17)25)28-23-20-6-3-2-5-19(20)21(16-27-23)24(30)26-9-4-10-29-11-13-31-14-12-29/h2-3,5-8,15-16H,4,9-14H2,1H3,(H,26,30)(H,27,28)