4-[2-(3-octan-3-yloxypropylcarbamoyl)hydrazinyl]-N,N-dioctyl-quinazoline-2-carboxamide

Systemtic Name: 4-[2-(3-octan-3-yloxypropylcarbamoyl)hydrazinyl]-N,N-dioctyl-quinazoline-2-carboxamide Openeye Name: 4-[2-[3-(1-ethylhexoxy)propylcarbamoyl]hydrazino]-N,N-dioctyl-quinazoline-2-carboxamide CAS Name: 4-[[(3-octan-3-yloxypropylamino)-oxomethyl]hydrazo]-N,N-dioctyl-2-quinazolinecarboxamide IUPAC Name: 4-[2-(3-octan-3-yloxypropylcarbamoyl)hydrazinyl]-N,N-dioctylquinazoline-2-carboxamide Traditional Name: 4-[N'-[3-(1-ethylhexoxy)propylcarbamoyl]hydrazino]-N,N-dioctyl-quinazoline-2-carboxamide Formula: C37H64N6O3 MolecularWeight: 640.94246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C(=O)C1=NC2=CC=CC=C2C(=N1)NNC(=O)NCCCOC(CC)CCCCC

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)C(=O)C1=NC2=CC=CC=C2C(=N1)NNC(=O)NCCCOC(CC)CCCCC

InChI

InChI=1S/C37H64N6O3/c1-5-9-12-14-16-21-28-43(29-22-17-15-13-10-6-2)36(44)35-39-33-26-20-19-25-32(33)34(40-35)41-42-37(45)38-27-23-30-46-31(8-4)24-18-11-7-3/h19-20,25-26,31H,5-18,21-24,27-30H2,1-4H3,(H2,38,42,45)(H,39,40,41)