3-methyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-methyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-methyl-N-[2-(3-pyridyl)-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-methyl-N-[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-methyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-methyl-N-[2-(3-pyridyl)-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide Formula: C22H15N3O2S MolecularWeight: 385.4384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C22H15N3O2S/c1-13-16-6-2-3-7-19(16)28-20(13)21(26)24-15-8-9-18-17(11-15)25-22(27-18)14-5-4-10-23-12-14/h2-12H,1H3,(H,24,26)