5-(butylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-methoxypropyl)benzamide

Systemtic Name: 5-(butylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-methoxypropyl)benzamide Openeye Name: 5-(butylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-methoxypropyl)benzamide CAS Name: 5-[[butylamino(oxo)methyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-methoxypropyl)benzamide IUPAC Name: 5-(butylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-methoxypropyl)benzamide Traditional Name: 5-(butylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-methoxypropyl)benzamide Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCCOC

Isomeric SMILES

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCCOC

InChI

InChI=1S/C25H34N4O3/c1-3-4-13-27-25(31)28-21-10-11-23(22(17-21)24(30)26-14-7-16-32-2)29-15-12-19-8-5-6-9-20(19)18-29/h5-6,8-11,17H,3-4,7,12-16,18H2,1-2H3,(H,26,30)(H2,27,28,31)