4-[4-azanyl-2-(diethylcarbamoyl)phenyl]-N-(3-methylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[4-azanyl-2-(diethylcarbamoyl)phenyl]-N-(3-methylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[4-amino-2-(diethylcarbamoyl)phenyl]-N-(m-tolyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[4-amino-2-[diethylamino(oxo)methyl]phenyl]-N-(3-methylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[4-amino-2-(diethylcarbamoyl)phenyl]-N-(3-methylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[4-amino-2-(diethylcarbamoyl)phenyl]-N-(m-tolyl)-1,4-diazepane-1-carboxamide Formula: C24H33N5O2 MolecularWeight: 423.55112

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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=CC(=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C24H33N5O2/c1-4-27(5-2)23(30)21-17-19(25)10-11-22(21)28-12-7-13-29(15-14-28)24(31)26-20-9-6-8-18(3)16-20/h6,8-11,16-17H,4-5,7,12-15,25H2,1-3H3,(H,26,31)