4-(phenylsulfonyl)-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(phenylsulfonyl)-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-(benzenesulfonyl)-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-besyl-N-(3-propargyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=CC=CC=C2SC1=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C#CCN1C2=CC=CC=C2SC1=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O3S2/c1-2-14-22-17-11-6-7-12-18(17)26-20(22)21-19(23)13-8-15-27(24,25)16-9-4-3-5-10-16/h1,3-7,9-12H,8,13-15H2