N-(4-bromanyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propanamide

Systemtic Name: N-(4-bromanyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propanamide Openeye Name: N-(4-bromo-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: N-(4-bromo-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide IUPAC Name: N-(4-bromo-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide Traditional Name: N-(4-bromo-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C17H15BrN2O4S2 MolecularWeight: 455.346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(S2)C=CC=C3Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(S2)C=CC=C3Br

InChI

InChI=1S/C17H15BrN2O4S2/c1-24-11-5-7-12(8-6-11)26(22,23)10-9-15(21)19-17-20-16-13(18)3-2-4-14(16)25-17/h2-8H,9-10H2,1H3,(H,19,20,21)