N-(6-bromanyl-1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyridylmethyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyridylmethyl)benzamide Formula: C23H20BrN3O4S MolecularWeight: 514.3916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C23H20BrN3O4S/c1-29-18-10-14(11-19(30-2)21(18)31-3)22(28)27(13-16-6-4-5-9-25-16)23-26-17-8-7-15(24)12-20(17)32-23/h4-12H,13H2,1-3H3