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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C23H15ClN2O2S/c1-13-14(23-26-17-9-3-4-11-18(17)28-23)8-6-10-16(13)25-22(27)21-20(24)15-7-2-5-12-19(15)29-21/h2-12H,1H3,(H,25,27)