5-(1-adamantylcarbamoylamino)-N-(2-diethylaminoethyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-(1-adamantylcarbamoylamino)-N-(2-diethylaminoethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-(1-adamantylcarbamoylamino)-N-(2-diethylaminoethyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(1-adamantylamino)-oxomethyl]amino]-N-(2-diethylaminoethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-(1-adamantylcarbamoylamino)-N-(2-diethylaminoethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(1-adamantylcarbamoylamino)-N-(2-diethylaminoethyl)-2-pyrrolidino-benzamide Formula: C28H43N5O2 MolecularWeight: 481.67332

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CCCC5

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CCCC5

InChI

InChI=1S/C28H43N5O2/c1-3-32(4-2)12-9-29-26(34)24-16-23(7-8-25(24)33-10-5-6-11-33)30-27(35)31-28-17-20-13-21(18-28)15-22(14-20)19-28/h7-8,16,20-22H,3-6,9-15,17-19H2,1-2H3,(H,29,34)(H2,30,31,35)