5-(butanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide

Systemtic Name: 5-(butanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-(butanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(1-oxobutylamino)benzamide IUPAC Name: 5-(butanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-butyramido-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C23H27N3O2 MolecularWeight: 377.47938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NC4CC4

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NC4CC4

InChI

InChI=1S/C23H27N3O2/c1-2-5-22(27)24-19-10-11-21(20(14-19)23(28)25-18-8-9-18)26-13-12-16-6-3-4-7-17(16)15-26/h3-4,6-7,10-11,14,18H,2,5,8-9,12-13,15H2,1H3,(H,24,27)(H,25,28)