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

Systemtic Name: 3-chloranyl-N-[3-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-(3,4-dimethoxyphenyl)isoxazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-(3,4-dimethoxyphenyl)-5-isoxazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3-(3,4-dimethoxyphenyl)isoxazol-5-yl]benzothiophene-2-carboxamide Formula: C20H15ClN2O4S MolecularWeight: 414.8621

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)OC

InChI

InChI=1S/C20H15ClN2O4S/c1-25-14-8-7-11(9-15(14)26-2)13-10-17(27-23-13)22-20(24)19-18(21)12-5-3-4-6-16(12)28-19/h3-10H,1-2H3,(H,22,24)