N-(4-azanylcyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(3-phenylpropanoyl)-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(3-phenylpropanoyl)-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(3-phenylpropanoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(1-oxo-3-phenylpropyl)-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(3-phenylpropanoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-hydrocinnamoyl-hexahydropyrimidine-2-carboxamide Formula: C26H32Cl2N4O4S MolecularWeight: 567.52768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3CCC(CC3)N)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(C(N(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3CCC(CC3)N)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H32Cl2N4O4S/c27-22-13-12-21(17-23(22)28)37(35,36)32-16-4-15-31(24(33)14-7-18-5-2-1-3-6-18)26(32)25(34)30-20-10-8-19(29)9-11-20/h1-3,5-6,12-13,17,19-20,26H,4,7-11,14-16,29H2,(H,30,34)