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

Systemtic Name: N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonyl-butanamide Openeye Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-(p-tolylsulfonyl)butanamide CAS Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonylbutanamide IUPAC Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfonylbutanamide Traditional Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-tosyl-butyramide Formula: C20H21BrN2O3S2 MolecularWeight: 481.42634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O3S2/c1-3-23-17-11-8-15(21)13-18(17)27-20(23)22-19(24)5-4-12-28(25,26)16-9-6-14(2)7-10-16/h6-11,13H,3-5,12H2,1-2H3