N-(2-azanylethyl)-1-cyclohexylcarbonyl-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-cyclohexylcarbonyl-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[cyclohexyl(oxo)methyl]-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide Formula: C20H29FN4O4S MolecularWeight: 440.532063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H29FN4O4S/c21-16-7-9-17(10-8-16)30(28,29)25-14-4-13-24(19(25)18(26)23-12-11-22)20(27)15-5-2-1-3-6-15/h7-10,15,19H,1-6,11-14,22H2,(H,23,26)