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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(4-fluorophenyl)sulfonyl-butanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(4-fluorophenyl)sulfonyl-butanamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(4-fluorophenyl)sulfonylbutanamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(4-fluorophenyl)sulfonylbutanamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(4-fluorophenyl)sulfonyl-butyramide Formula: C23H27ClFN3O3S2 MolecularWeight: 512.060183

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H27ClFN3O3S2/c1-3-27(4-2)13-14-28(23-26-20-12-7-17(24)16-21(20)32-23)22(29)6-5-15-33(30,31)19-10-8-18(25)9-11-19/h7-12,16H,3-6,13-15H2,1-2H3