N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-4-(phenylsulfonyl)butanamide

Systemtic Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]butanamide CAS Name: 4-(benzenesulfonyl)-N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(benzenesulfonyl)-N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]butanamide Traditional Name: 4-besyl-N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]butyramide Formula: C23H28N2O4S2 MolecularWeight: 460.60942

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC(=CC(=C2SC1=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOCCN1C2=CC(=CC(=C2SC1=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C23H28N2O4S2/c1-4-29-13-12-25-20-16-17(2)15-18(3)22(20)30-23(25)24-21(26)11-8-14-31(27,28)19-9-6-5-7-10-19/h5-7,9-10,15-16H,4,8,11-14H2,1-3H3