4-tert-butyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-tert-butyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-tert-butyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide CAS Name: 4-tert-butyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-tert-butyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-tert-butyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C26H27N3O2S/c1-5-31-21-10-8-11-22-23(21)28-25(32-22)29(17-20-9-6-7-16-27-20)24(30)18-12-14-19(15-13-18)26(2,3)4/h6-16H,5,17H2,1-4H3