S-[2-[(2-chloranyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] 2,3-dihydro-1,4-benzoxazine-4-carbothioate

Systemtic Name: S-[2-[(2-chloranyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] 2,3-dihydro-1,4-benzoxazine-4-carbothioate Openeye Name: S-[2-(2-chloro-4-sulfamoyl-anilino)-2-oxo-ethyl] 2,3-dihydro-1,4-benzoxazine-4-carbothioate CAS Name: 2,3-dihydro-1,4-benzoxazine-4-carbothioic acid S-[2-(2-chloro-4-sulfamoylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(2-chloro-4-sulfamoylanilino)-2-oxoethyl] 2,3-dihydro-1,4-benzoxazine-4-carbothioate Traditional Name: 2,3-dihydro-1,4-benzoxazine-4-carbothioic acid S-[2-(2-chloro-4-sulfamoyl-anilino)-2-keto-ethyl] ester Formula: C17H16ClN3O5S2 MolecularWeight: 441.90904

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N1C(=O)SCC(=O)NC3=C(C=C(C=C3)S(=O)(=O)N)Cl

Isomeric SMILES

C1COC2=CC=CC=C2N1C(=O)SCC(=O)NC3=C(C=C(C=C3)S(=O)(=O)N)Cl

InChI

InChI=1S/C17H16ClN3O5S2/c18-12-9-11(28(19,24)25)5-6-13(12)20-16(22)10-27-17(23)21-7-8-26-15-4-2-1-3-14(15)21/h1-6,9H,7-8,10H2,(H,20,22)(H2,19,24,25)