[(2S)-3-methylsulfonyl-5-oxidanylidene-1,2-diphenyl-2H-pyrrol-4-yl] N,N'-dicyclohexylcarbamimidate

Systemtic Name: [(2S)-3-methylsulfonyl-5-oxidanylidene-1,2-diphenyl-2H-pyrrol-4-yl] N,N'-dicyclohexylcarbamimidate Openeye Name: 1,3-dicyclohexyl-2-[(2S)-3-methylsulfonyl-5-oxo-1,2-diphenyl-2H-pyrrol-4-yl]isourea CAS Name: N,N'-dicyclohexylcarbamimidic acid [(2S)-3-methylsulfonyl-5-oxo-1,2-diphenyl-2H-pyrrol-4-yl] ester IUPAC Name: [(2S)-3-methylsulfonyl-5-oxo-1,2-diphenyl-2H-pyrrol-4-yl] N,N'-dicyclohexylcarbamimidate Traditional Name: 1,3-dicyclohexyl-2-[(5S)-2-keto-4-mesyl-1,5-diphenyl-3-pyrrolin-3-yl]isourea Formula: C30H37N3O4S MolecularWeight: 535.69748

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)C3=CC=CC=C3)OC(=NC4CCCCC4)NC5CCCCC5

Isomeric SMILES

CS(=O)(=O)C1=C(C(=O)N([C@H]1C2=CC=CC=C2)C3=CC=CC=C3)OC(=NC4CCCCC4)NC5CCCCC5

InChI

InChI=1S/C30H37N3O4S/c1-38(35,36)28-26(22-14-6-2-7-15-22)33(25-20-12-5-13-21-25)29(34)27(28)37-30(31-23-16-8-3-9-17-23)32-24-18-10-4-11-19-24/h2,5-7,12-15,20-21,23-24,26H,3-4,8-11,16-19H2,1H3,(H,31,32)/t26-/m0/s1