N-[6-[4-(2,4-dichlorophenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]cyclohexanecarboxamide

Systemtic Name: N-[6-[4-(2,4-dichlorophenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]cyclohexanecarboxamide Openeye Name: N-[6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]cyclohexanecarboxamide CAS Name: N-[6-[4-[(2,4-dichlorophenyl)-oxomethyl]-1,4-diazepan-1-yl]-3-pyridinyl]cyclohexanecarboxamide IUPAC Name: N-[6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl]cyclohexanecarboxamide Traditional Name: N-[6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]cyclohexanecarboxamide Formula: C24H28Cl2N4O2 MolecularWeight: 475.41072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H28Cl2N4O2/c25-18-7-9-20(21(26)15-18)24(32)30-12-4-11-29(13-14-30)22-10-8-19(16-27-22)28-23(31)17-5-2-1-3-6-17/h7-10,15-17H,1-6,11-14H2,(H,28,31)