4-[(5-chloranyl-1,3-benzoxazol-2-yl)methyl]-N-(3-chlorophenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[(5-chloranyl-1,3-benzoxazol-2-yl)methyl]-N-(3-chlorophenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-chlorophenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-chlorophenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-chlorophenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-chlorophenyl)-1,4-diazepane-1-carboxamide Formula: C20H20Cl2N4O2 MolecularWeight: 419.3044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)Cl)CC3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)Cl)CC3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C20H20Cl2N4O2/c21-14-3-1-4-16(11-14)23-20(27)26-8-2-7-25(9-10-26)13-19-24-17-12-15(22)5-6-18(17)28-19/h1,3-6,11-12H,2,7-10,13H2,(H,23,27)