N-(4-azanylcyclohexyl)-1-(4-tert-butylphenyl)carbonyl-3-(3,4-dichlorophenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(4-tert-butylphenyl)carbonyl-3-(3,4-dichlorophenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-3-(3,4-dichlorobenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(4-tert-butylphenyl)-oxomethyl]-3-[(3,4-dichlorophenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-3-(3,4-dichlorobenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-3-(3,4-dichlorobenzoyl)hexahydropyrimidine-2-carboxamide Formula: C29H36Cl2N4O3 MolecularWeight: 559.52714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C29H36Cl2N4O3/c1-29(2,3)20-8-5-18(6-9-20)27(37)34-15-4-16-35(28(38)19-7-14-23(30)24(31)17-19)26(34)25(36)33-22-12-10-21(32)11-13-22/h5-9,14,17,21-22,26H,4,10-13,15-16,32H2,1-3H3,(H,33,36)