N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3-tosyl-propionamide Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C)C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C)C)C

InChI

InChI=1S/C21H24N2O3S2/c1-5-23-19-15(3)8-9-16(4)20(19)27-21(23)22-18(24)12-13-28(25,26)17-10-6-14(2)7-11-17/h6-11H,5,12-13H2,1-4H3