(5-chloranylthiophen-2-yl)methyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]ammonium Formula: C17H21ClN3O3S2+ MolecularWeight: 414.94994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+](CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+](CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C17H20ClN3O3S2/c1-3-10-21(11-14-6-9-16(18)25-14)12(2)17(22)20-13-4-7-15(8-5-13)26(19,23)24/h3-9,12H,1,10-11H2,2H3,(H,20,22)(H2,19,23,24)/p+1/t12-/m1/s1