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

Systemtic Name: S-(methylamino) N-[2-(4-methoxy-2-phenyl-piperidin-1-yl)-3-(sulfonylamino)propanoyl]carbamothioate Openeye Name: S-(methylamino) N-[2-(4-methoxy-2-phenyl-1-piperidyl)-3-(sulfonylamino)propanoyl]carbamothioate CAS Name: N-[2-(4-methoxy-2-phenyl-1-piperidinyl)-1-oxo-3-(sulfonylamino)propyl]carbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-[2-(4-methoxy-2-phenylpiperidin-1-yl)-3-(sulfonylamino)propanoyl]carbamothioate Traditional Name: N-[2-(4-methoxy-2-phenyl-piperidino)-3-(sulfonylamino)propanoyl]thiocarbamic acid S-(methylamino) ester Formula: C17H24N4O5S2 MolecularWeight: 428.52626

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Descriptors Computed from Structure

Canonical SMILES:

CNSC(=O)NC(=O)C(CN=S(=O)=O)N1CCC(CC1C2=CC=CC=C2)OC

Isomeric SMILES

CNSC(=O)NC(=O)C(CN=S(=O)=O)N1CCC(CC1C2=CC=CC=C2)OC

InChI

InChI=1S/C17H24N4O5S2/c1-18-27-17(23)20-16(22)15(11-19-28(24)25)21-9-8-13(26-2)10-14(21)12-6-4-3-5-7-12/h3-7,13-15,18H,8-11H2,1-2H3,(H,20,22,23)