N-[(2,4-dichlorophenyl)methyl]-4-(pyridin-2-ylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-4-(pyridin-2-ylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-4-(2-pyridylmethyl)-1,4-diazepane-1-carboxamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-4-(2-pyridinylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-4-(pyridin-2-ylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2,4-dichlorobenzyl)-4-(2-pyridylmethyl)-1,4-diazepane-1-carboxamide Formula: C19H22Cl2N4O MolecularWeight: 393.31018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCC2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=N3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCC2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=N3

InChI

InChI=1S/C19H22Cl2N4O/c20-16-6-5-15(18(21)12-16)13-23-19(26)25-9-3-8-24(10-11-25)14-17-4-1-2-7-22-17/h1-2,4-7,12H,3,8-11,13-14H2,(H,23,26)