N-[2-[butyl(ethyl)amino]ethyl]-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide

Systemtic Name: N-[2-[butyl(ethyl)amino]ethyl]-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide Openeye Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(2-methoxyanilino)isoquinoline-4-carboxamide CAS Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(2-methoxyanilino)-4-isoquinolinecarboxamide IUPAC Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(2-methoxyanilino)isoquinoline-4-carboxamide Traditional Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(o-anisidino)isoquinoline-4-carboxamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)CCNC(=O)C1=CN=C(C2=CC=CC=C21)NC3=CC=CC=C3OC

Isomeric SMILES

CCCCN(CC)CCNC(=O)C1=CN=C(C2=CC=CC=C21)NC3=CC=CC=C3OC

InChI

InChI=1S/C25H32N4O2/c1-4-6-16-29(5-2)17-15-26-25(30)21-18-27-24(20-12-8-7-11-19(20)21)28-22-13-9-10-14-23(22)31-3/h7-14,18H,4-6,15-17H2,1-3H3,(H,26,30)(H,27,28)