5-(1-adamantylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide

Systemtic Name: 5-(1-adamantylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide Openeye Name: 5-(1-adamantylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide CAS Name: 5-[[(1-adamantylamino)-oxomethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide IUPAC Name: 5-(1-adamantylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide Traditional Name: 5-(1-adamantylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide Formula: C30H38N4O2 MolecularWeight: 486.64832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CCC6=CC=CC=C6C5

Isomeric SMILES

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C30H38N4O2/c1-19(2)31-28(35)26-14-25(7-8-27(26)34-10-9-23-5-3-4-6-24(23)18-34)32-29(36)33-30-15-20-11-21(16-30)13-22(12-20)17-30/h3-8,14,19-22H,9-13,15-18H2,1-2H3,(H,31,35)(H2,32,33,36)