2-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-methoxy-3-morpholinosulfonyl-phenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-methoxy-3-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-methoxy-3-morpholin-4-ylsulfonylphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(4-methoxy-3-morpholinosulfonyl-phenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C16H27N4O4S2+ MolecularWeight: 403.53998

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCOCC2

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C16H26N4O4S2/c1-19(2)7-6-17-16(25)18-13-4-5-14(23-3)15(12-13)26(21,22)20-8-10-24-11-9-20/h4-5,12H,6-11H2,1-3H3,(H2,17,18,25)/p+1