S-(methylamino) N-(4-methylpentyl)-N-[2-phenyl-3-(sulfonylamino)cyclopropyl]carbonyl-carbamothioate

Systemtic Name: S-(methylamino) N-(4-methylpentyl)-N-[2-phenyl-3-(sulfonylamino)cyclopropyl]carbonyl-carbamothioate Openeye Name: S-(methylamino) N-isohexyl-N-[2-phenyl-3-(sulfonylamino)cyclopropanecarbonyl]carbamothioate CAS Name: N-(4-methylpentyl)-N-[oxo-[2-phenyl-3-(sulfonylamino)cyclopropyl]methyl]carbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-(4-methylpentyl)-N-[2-phenyl-3-(sulfonylamino)cyclopropanecarbonyl]carbamothioate Traditional Name: N-isohexyl-N-[2-phenyl-3-(sulfonylamino)cyclopropanecarbonyl]thiocarbamic acid S-(methylamino) ester Formula: C18H25N3O4S2 MolecularWeight: 411.5388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN(C(=O)C1C(C1N=S(=O)=O)C2=CC=CC=C2)C(=O)SNC

Isomeric SMILES

CC(C)CCCN(C(=O)C1C(C1N=S(=O)=O)C2=CC=CC=C2)C(=O)SNC

InChI

InChI=1S/C18H25N3O4S2/c1-12(2)8-7-11-21(18(23)26-19-3)17(22)15-14(16(15)20-27(24)25)13-9-5-4-6-10-13/h4-6,9-10,12,14-16,19H,7-8,11H2,1-3H3