[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-[(4-sulfamoylphenyl)methyl]azanium

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-[(4-sulfamoylphenyl)methyl]azanium Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]-[(4-sulfamoylphenyl)methyl]ammonium CAS Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-[(4-sulfamoylphenyl)methyl]ammonium IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-[(4-sulfamoylphenyl)methyl]azanium Traditional Name: [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]-(4-sulfamoylbenzyl)ammonium Formula: C16H17N4O3S2+ MolecularWeight: 377.46118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C[NH2+]CC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C[NH2+]CC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H16N4O3S2/c17-25(22,23)12-7-5-11(6-8-12)9-18-10-15(21)20-16-19-13-3-1-2-4-14(13)24-16/h1-8,18H,9-10H2,(H2,17,22,23)(H,19,20,21)/p+1