N-(3-hydroxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(3-hydroxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(3-hydroxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(3-hydroxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3-hydroxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(3-hydroxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxamide Formula: C21H17N3O5S2 MolecularWeight: 455.50678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC(=CC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC(=CC=C4)O

InChI

InChI=1S/C21H17N3O5S2/c1-29-16-6-8-17(9-7-16)31(27,28)24-21-23-18-10-5-13(11-19(18)30-21)20(26)22-14-3-2-4-15(25)12-14/h2-12,25H,1H3,(H,22,26)(H,23,24)