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

Systemtic Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-3-chloro-benzothiophene-2-carboxamide Formula: C26H21ClN2O2S MolecularWeight: 460.97514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(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)(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/C26H21ClN2O2S/c1-26(2,3)16-10-8-15(9-11-16)25-29-19-14-17(12-13-20(19)31-25)28-24(30)23-22(27)18-6-4-5-7-21(18)32-23/h4-14H,1-3H3,(H,28,30)