4-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide CAS Name: 4-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-tert-butyl-N-(6-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=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

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