S-(methylamino) N-[2-ethyl-2-[methoxy-phenyl-(sulfonylamino)methyl]butanoyl]carbamothioate

Systemtic Name: S-(methylamino) N-[2-ethyl-2-[methoxy-phenyl-(sulfonylamino)methyl]butanoyl]carbamothioate Openeye Name: S-(methylamino) N-[2-ethyl-2-[methoxy-phenyl-(sulfonylamino)methyl]butanoyl]carbamothioate CAS Name: N-[2-ethyl-2-[methoxy-phenyl-(sulfonylamino)methyl]-1-oxobutyl]carbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-[2-ethyl-2-[methoxy-phenyl-(sulfonylamino)methyl]butanoyl]carbamothioate Traditional Name: N-[2-ethyl-2-[methoxy-phenyl-(sulfonylamino)methyl]butanoyl]thiocarbamic acid S-(methylamino) ester Formula: C16H23N3O5S2 MolecularWeight: 401.50092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)NC(=O)SNC)C(C1=CC=CC=C1)(N=S(=O)=O)OC

Isomeric SMILES

CCC(CC)(C(=O)NC(=O)SNC)C(C1=CC=CC=C1)(N=S(=O)=O)OC

InChI

InChI=1S/C16H23N3O5S2/c1-5-15(6-2,13(20)18-14(21)25-17-3)16(24-4,19-26(22)23)12-10-8-7-9-11-12/h7-11,17H,5-6H2,1-4H3,(H,18,20,21)