3-chloranyl-N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide Formula: C24H17ClN2O2S MolecularWeight: 432.92198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl)C

InChI

InChI=1S/C24H17ClN2O2S/c1-13-7-9-16(14(2)11-13)24-27-18-12-15(8-10-19(18)29-24)26-23(28)22-21(25)17-5-3-4-6-20(17)30-22/h3-12H,1-2H3,(H,26,28)