N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-pentoxy-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-pentoxy-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-pentoxy-N-(2-pyridylmethyl)benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-pentoxy-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-pentoxy-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-amoxy-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=C(C=C4S3)C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=C(C=C4S3)C)C

InChI

InChI=1S/C27H29N3O2S/c1-4-5-8-15-32-23-12-10-21(11-13-23)26(31)30(18-22-9-6-7-14-28-22)27-29-25-20(3)16-19(2)17-24(25)33-27/h6-7,9-14,16-17H,4-5,8,15,18H2,1-3H3