N-(4-bromanyl-2-methyl-phenyl)-4-methyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-4-methyl-1,4-diazepane-1-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-4-methyl-1,4-diazepane-1-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-4-methyl-1,4-diazepane-1-carboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-4-methyl-1,4-diazepane-1-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-methyl-1,4-diazepane-1-carboxamide Formula: C14H20BrN3O MolecularWeight: 326.2321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)N2CCCN(CC2)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)N2CCCN(CC2)C

InChI

InChI=1S/C14H20BrN3O/c1-11-10-12(15)4-5-13(11)16-14(19)18-7-3-6-17(2)8-9-18/h4-5,10H,3,6-9H2,1-2H3,(H,16,19)