5-(dimethylsulfamoyl)-N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-methyl-furan-3-carboxamide

Systemtic Name: 5-(dimethylsulfamoyl)-N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-methyl-furan-3-carboxamide Openeye Name: 5-(dimethylsulfamoyl)-N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-methyl-furan-3-carboxamide CAS Name: 5-(dimethylsulfamoyl)-N-[2-(hept-3-ynylthio)-1,3-benzothiazol-6-yl]-2-methyl-3-furancarboxamide IUPAC Name: 5-(dimethylsulfamoyl)-N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-methylfuran-3-carboxamide Traditional Name: 5-(dimethylsulfamoyl)-N-[2-(hept-3-ynylthio)-1,3-benzothiazol-6-yl]-2-methyl-3-furamide Formula: C22H25N3O4S3 MolecularWeight: 491.6466

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(OC(=C3)S(=O)(=O)N(C)C)C

Isomeric SMILES

CCCC#CCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(OC(=C3)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C22H25N3O4S3/c1-5-6-7-8-9-12-30-22-24-18-11-10-16(13-19(18)31-22)23-21(26)17-14-20(29-15(17)2)32(27,28)25(3)4/h10-11,13-14H,5-6,9,12H2,1-4H3,(H,23,26)