N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[methyl-(phenylmethyl)sulfamoyl]benzamide

Systemtic Name: N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[methyl-(phenylmethyl)sulfamoyl]benzamide Openeye Name: 4-[benzyl(methyl)sulfamoyl]-N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[methyl-(phenylmethyl)sulfamoyl]benzamide IUPAC Name: 4-[benzyl(methyl)sulfamoyl]-N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-[benzyl(methyl)sulfamoyl]-N-(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C25H20BrN3O3S2 MolecularWeight: 554.4786

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)Br)CC#C

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)Br)CC#C

InChI

InChI=1S/C25H20BrN3O3S2/c1-3-15-29-22-14-11-20(26)16-23(22)33-25(29)27-24(30)19-9-12-21(13-10-19)34(31,32)28(2)17-18-7-5-4-6-8-18/h1,4-14,16H,15,17H2,2H3