S-(methylamino) N-[2-(4-methoxyphenyl)-5-(sulfonylamino)nonanoyl]-N-methyl-carbamothioate

Systemtic Name: S-(methylamino) N-[2-(4-methoxyphenyl)-5-(sulfonylamino)nonanoyl]-N-methyl-carbamothioate Openeye Name: S-(methylamino) N-[2-(4-methoxyphenyl)-5-(sulfonylamino)nonanoyl]-N-methyl-carbamothioate CAS Name: N-[2-(4-methoxyphenyl)-1-oxo-5-(sulfonylamino)nonyl]-N-methylcarbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-[2-(4-methoxyphenyl)-5-(sulfonylamino)nonanoyl]-N-methylcarbamothioate Traditional Name: N-[2-(4-methoxyphenyl)-5-(sulfonylamino)nonanoyl]-N-methyl-thiocarbamic acid S-(methylamino) ester Formula: C19H29N3O5S2 MolecularWeight: 443.58066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O5S2/c1-5-6-7-15(21-29(25)26)10-13-17(14-8-11-16(27-4)12-9-14)18(23)22(3)19(24)28-20-2/h8-9,11-12,15,17,20H,5-7,10,13H2,1-4H3