S-(methylamino) N-[2-(4-methoxy-2-phenyl-pyrrolidin-1-yl)-3-(sulfonylamino)propanoyl]carbamothioate

Systemtic Name: S-(methylamino) N-[2-(4-methoxy-2-phenyl-pyrrolidin-1-yl)-3-(sulfonylamino)propanoyl]carbamothioate Openeye Name: S-(methylamino) N-[2-(4-methoxy-2-phenyl-pyrrolidin-1-yl)-3-(sulfonylamino)propanoyl]carbamothioate CAS Name: N-[2-(4-methoxy-2-phenyl-1-pyrrolidinyl)-1-oxo-3-(sulfonylamino)propyl]carbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-[2-(4-methoxy-2-phenylpyrrolidin-1-yl)-3-(sulfonylamino)propanoyl]carbamothioate Traditional Name: N-[2-(4-methoxy-2-phenyl-pyrrolidino)-3-(sulfonylamino)propanoyl]thiocarbamic acid S-(methylamino) ester Formula: C16H22N4O5S2 MolecularWeight: 414.49968

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Descriptors Computed from Structure

Canonical SMILES:

CNSC(=O)NC(=O)C(CN=S(=O)=O)N1CC(CC1C2=CC=CC=C2)OC

Isomeric SMILES

CNSC(=O)NC(=O)C(CN=S(=O)=O)N1CC(CC1C2=CC=CC=C2)OC

InChI

InChI=1S/C16H22N4O5S2/c1-17-26-16(22)19-15(21)14(9-18-27(23)24)20-10-12(25-2)8-13(20)11-6-4-3-5-7-11/h3-7,12-14,17H,8-10H2,1-2H3,(H,19,21,22)