N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-benzamide

Systemtic Name: N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-benzamide Openeye Name: N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-benzamide CAS Name: N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide IUPAC Name: N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide Traditional Name: N-butyl-2-mesyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CCCCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C20H22N2O3S2/c1-4-5-12-22(20-21-16-11-10-14(2)13-17(16)26-20)19(23)15-8-6-7-9-18(15)27(3,24)25/h6-11,13H,4-5,12H2,1-3H3