S-(methylamino) N-(4-methoxyhexyl)-N-[2-phenyl-1-(sulfonylamino)cyclopropyl]carbonyl-carbamothioate

Systemtic Name: S-(methylamino) N-(4-methoxyhexyl)-N-[2-phenyl-1-(sulfonylamino)cyclopropyl]carbonyl-carbamothioate Openeye Name: S-(methylamino) N-(4-methoxyhexyl)-N-[2-phenyl-1-(sulfonylamino)cyclopropanecarbonyl]carbamothioate CAS Name: N-(4-methoxyhexyl)-N-[oxo-[2-phenyl-1-(sulfonylamino)cyclopropyl]methyl]carbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-(4-methoxyhexyl)-N-[2-phenyl-1-(sulfonylamino)cyclopropanecarbonyl]carbamothioate Traditional Name: N-(4-methoxyhexyl)-N-[2-phenyl-1-(sulfonylamino)cyclopropanecarbonyl]thiocarbamic acid S-(methylamino) ester Formula: C19H27N3O5S2 MolecularWeight: 441.56478

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCN(C(=O)C1(CC1C2=CC=CC=C2)N=S(=O)=O)C(=O)SNC)OC

Isomeric SMILES

CCC(CCCN(C(=O)C1(CC1C2=CC=CC=C2)N=S(=O)=O)C(=O)SNC)OC

InChI

InChI=1S/C19H27N3O5S2/c1-4-15(27-3)11-8-12-22(18(24)28-20-2)17(23)19(21-29(25)26)13-16(19)14-9-6-5-7-10-14/h5-7,9-10,15-16,20H,4,8,11-13H2,1-3H3