N-(1,3-benzothiazol-2-yl)-2-(3-bromanyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(3-bromanyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-methylsulfonylphenyl)-3-cyclopentylpropanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-methylsulfonylphenyl)-3-cyclopentylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-mesyl-phenyl)-3-cyclopentyl-propionamide Formula: C22H23BrN2O3S2 MolecularWeight: 507.46362

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C22H23BrN2O3S2/c1-30(27,28)20-11-10-15(13-17(20)23)16(12-14-6-2-3-7-14)21(26)25-22-24-18-8-4-5-9-19(18)29-22/h4-5,8-11,13-14,16H,2-3,6-7,12H2,1H3,(H,24,25,26)