N-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonyl-butanamide

Systemtic Name: N-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonyl-butanamide Openeye Name: N-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-(p-tolylsulfonyl)butanamide CAS Name: N-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonylbutanamide IUPAC Name: N-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonylbutanamide Traditional Name: N-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-tosyl-butyramide Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C(=C2)C)C)SC1=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C2=C(C=C(C(=C2)C)C)SC1=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N2O3S2/c1-5-24-19-13-16(3)17(4)14-20(19)28-22(24)23-21(25)7-6-12-29(26,27)18-10-8-15(2)9-11-18/h8-11,13-14H,5-7,12H2,1-4H3