N-(4-azanylcyclohexyl)-1-(5-bromanylpyridin-3-yl)carbonyl-3-(3,4-dichlorophenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(5-bromanylpyridin-3-yl)carbonyl-3-(3,4-dichlorophenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(5-bromopyridine-3-carbonyl)-3-(3,4-dichlorobenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(5-bromo-3-pyridinyl)-oxomethyl]-3-[(3,4-dichlorophenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(5-bromopyridine-3-carbonyl)-3-(3,4-dichlorobenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(5-bromonicotinoyl)-3-(3,4-dichlorobenzoyl)hexahydropyrimidine-2-carboxamide Formula: C24H26BrCl2N5O3 MolecularWeight: 583.30494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)C(=O)C2=CC(=CN=C2)Br)C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(C(N(C1)C(=O)C2=CC(=CN=C2)Br)C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H26BrCl2N5O3/c25-16-10-15(12-29-13-16)24(35)32-9-1-8-31(23(34)14-2-7-19(26)20(27)11-14)22(32)21(33)30-18-5-3-17(28)4-6-18/h2,7,10-13,17-18,22H,1,3-6,8-9,28H2,(H,30,33)