N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfonyl-butanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfonyl-butanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfonyl-butanamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfonylbutanamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfonylbutanamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfonyl-butyramide Formula: C17H14ClFN2O3S2 MolecularWeight: 412.886063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)S(=O)(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1F)S(=O)(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C17H14ClFN2O3S2/c18-11-3-8-14-15(10-11)25-17(20-14)21-16(22)2-1-9-26(23,24)13-6-4-12(19)5-7-13/h3-8,10H,1-2,9H2,(H,20,21,22)