N-(4-azanylcyclohexyl)-1-(3,4-dimethoxyphenyl)carbonyl-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3,4-dimethoxyphenyl)carbonyl-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3,4-dimethoxybenzoyl)-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(3,4-dimethoxyphenyl)-oxomethyl]-3-(4-fluorophenyl)sulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3,4-dimethoxybenzoyl)-3-(4-fluorophenyl)sulfonylimidazolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(4-fluorophenyl)sulfonyl-3-veratroyl-imidazolidine-2-carboxamide Formula: C25H31FN4O6S MolecularWeight: 534.600243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C25H31FN4O6S/c1-35-21-12-3-16(15-22(21)36-2)25(32)29-13-14-30(37(33,34)20-10-4-17(26)5-11-20)24(29)23(31)28-19-8-6-18(27)7-9-19/h3-5,10-12,15,18-19,24H,6-9,13-14,27H2,1-2H3,(H,28,31)