N-(4-azanylcyclohexyl)-1-(2-cyclopentyl-2-phenyl-ethanoyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(2-cyclopentyl-2-phenyl-ethanoyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(2-cyclopentyl-2-phenyl-acetyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-(2-cyclopentyl-1-oxo-2-phenylethyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(2-cyclopentyl-2-phenylacetyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(2-cyclopentyl-2-phenyl-acetyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide Formula: C30H39FN4O4S MolecularWeight: 570.718463

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)C(=O)N3CCCN(C3C(=O)NC4CCC(CC4)N)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)C(=O)N3CCCN(C3C(=O)NC4CCC(CC4)N)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C30H39FN4O4S/c31-23-11-17-26(18-12-23)40(38,39)35-20-6-19-34(29(35)28(36)33-25-15-13-24(32)14-16-25)30(37)27(22-9-4-5-10-22)21-7-2-1-3-8-21/h1-3,7-8,11-12,17-18,22,24-25,27,29H,4-6,9-10,13-16,19-20,32H2,(H,33,36)