(NE)-N-[(5E)-3-cyclohexyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]thiophene-2-sulfonamide

Systemtic Name: (NE)-N-[(5E)-3-cyclohexyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]thiophene-2-sulfonamide Openeye Name: (NE)-N-[(5E)-3-cyclohexyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-thiazolidin-2-ylidene]thiophene-2-sulfonamide CAS Name: (NE)-N-[(5E)-3-cyclohexyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-2-thiazolidinylidene]-2-thiophenesulfonamide IUPAC Name: (NE)-N-[(5E)-3-cyclohexyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]thiophene-2-sulfonamide Traditional Name: (NE)-N-[(5E)-3-cyclohexyl-4-keto-5-(3-methyl-1,3-benzothiazol-2-ylidene)thiazolidin-2-ylidene]thiophene-2-sulfonamide Formula: C21H21N3O3S4 MolecularWeight: 491.66974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=C3C(=O)N(C(=NS(=O)(=O)C4=CC=CS4)S3)C5CCCCC5

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=C/3\C(=O)N(/C(=N\S(=O)(=O)C4=CC=CS4)/S3)C5CCCCC5

InChI

InChI=1S/C21H21N3O3S4/c1-23-15-10-5-6-11-16(15)29-20(23)18-19(25)24(14-8-3-2-4-9-14)21(30-18)22-31(26,27)17-12-7-13-28-17/h5-7,10-14H,2-4,8-9H2,1H3/b20-18+,22-21+