N-(6-ethyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-mesyl-N-(2-pyridylmethyl)benzamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C23H21N3O3S2/c1-3-16-11-12-19-20(14-16)30-23(25-19)26(15-17-8-6-7-13-24-17)22(27)18-9-4-5-10-21(18)31(2,28)29/h4-14H,3,15H2,1-2H3