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

Systemtic Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(1,3-benzoxazol-2-yl)benzyl]-3-chloro-benzothiophene-2-carboxamide Formula: C23H15ClN2O2S MolecularWeight: 418.8954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4)Cl

InChI

InChI=1S/C23H15ClN2O2S/c24-20-16-5-1-4-8-19(16)29-21(20)22(27)25-13-14-9-11-15(12-10-14)23-26-17-6-2-3-7-18(17)28-23/h1-12H,13H2,(H,25,27)