N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenyl-butanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenyl-butanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenyl-butanamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenylbutanamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenylbutanamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-4-phenyl-butyramide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S2/c1-25(22,23)14-10-11-15-16(12-14)24-18(19-15)20-17(21)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,19,20,21)