N-(4-chloranyl-1,3-benzothiazol-7-yl)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-7-yl)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(4-chloro-1,3-benzothiazol-7-yl)butanamide CAS Name: 4-(benzenesulfonyl)-N-(4-chloro-1,3-benzothiazol-7-yl)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(4-chloro-1,3-benzothiazol-7-yl)butanamide Traditional Name: 4-besyl-N-(4-chloro-1,3-benzothiazol-7-yl)butyramide Formula: C17H15ClN2O3S2 MolecularWeight: 394.8956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=C3C(=C(C=C2)Cl)N=CS3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=C3C(=C(C=C2)Cl)N=CS3

InChI

InChI=1S/C17H15ClN2O3S2/c18-13-8-9-14(17-16(13)19-11-24-17)20-15(21)7-4-10-25(22,23)12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2,(H,20,21)