4-[4-azanyl-2-(diethylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[4-azanyl-2-(diethylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[4-amino-2-(diethylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[4-amino-2-[diethylamino(oxo)methyl]phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[4-amino-2-(diethylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[4-amino-2-(diethylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=CC(=C1)N)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=CC(=C1)N)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H33N5O3/c1-4-27(5-2)23(30)21-17-18(25)7-12-22(21)28-13-6-14-29(16-15-28)24(31)26-19-8-10-20(32-3)11-9-19/h7-12,17H,4-6,13-16,25H2,1-3H3,(H,26,31)