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

Systemtic Name: N-(4-azanylcyclohexyl)-1-(4-tert-butylphenyl)carbonyl-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-3-(3,4-dichlorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(4-tert-butylphenyl)-oxomethyl]-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-3-(3,4-dichlorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide Formula: C28H36Cl2N4O4S MolecularWeight: 595.58084

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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)S(=O)(=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)S(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C28H36Cl2N4O4S/c1-28(2,3)19-7-5-18(6-8-19)27(36)33-15-4-16-34(39(37,38)22-13-14-23(29)24(30)17-22)26(33)25(35)32-21-11-9-20(31)10-12-21/h5-8,13-14,17,20-21,26H,4,9-12,15-16,31H2,1-3H3,(H,32,35)