5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholinoethyl)benzamide CAS Name: 5-[(3-cyclopentyl-1-oxopropyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholinoethyl)benzamide Formula: C30H40N4O3 MolecularWeight: 504.6636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCCN5CCOCC5

Isomeric SMILES

C1CCC(C1)CCC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCCN5CCOCC5

InChI

InChI=1S/C30H40N4O3/c35-29(12-9-23-5-1-2-6-23)32-26-10-11-28(34-15-13-24-7-3-4-8-25(24)22-34)27(21-26)30(36)31-14-16-33-17-19-37-20-18-33/h3-4,7-8,10-11,21,23H,1-2,5-6,9,12-20,22H2,(H,31,36)(H,32,35)