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

Systemtic Name: 3-chloranyl-N-[2-(4-propan-2-ylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-isopropylphenyl)-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(4-propan-2-ylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-propan-2-ylphenyl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-p-cumenyl-1,3-benzoxazol-5-yl)benzothiophene-2-carboxamide Formula: C25H19ClN2O2S MolecularWeight: 446.94856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H19ClN2O2S/c1-14(2)15-7-9-16(10-8-15)25-28-19-13-17(11-12-20(19)30-25)27-24(29)23-22(26)18-5-3-4-6-21(18)31-23/h3-14H,1-2H3,(H,27,29)