N-(4-ethyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-mesyl-N-(2-pyridylmethyl)benzamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

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