N-(3-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-(3-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-(3-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[3-(2-benzo[e][1,3]benzoxazolyl)phenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-chloro-benzothiophene-2-carboxamide Formula: C26H15ClN2O2S MolecularWeight: 454.9275

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)C4=CC(=CC=C4)NC(=O)C5=C(C6=CC=CC=C6S5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)C4=CC(=CC=C4)NC(=O)C5=C(C6=CC=CC=C6S5)Cl

InChI

InChI=1S/C26H15ClN2O2S/c27-22-19-10-3-4-11-21(19)32-24(22)25(30)28-17-8-5-7-16(14-17)26-29-23-18-9-2-1-6-15(18)12-13-20(23)31-26/h1-14H,(H,28,30)