N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]benzothiophene-2-carboxamide CAS Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]benzothiophene-2-carboxamide Formula: C26H20Cl2N2O2S MolecularWeight: 495.4202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Cl)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Cl)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C26H20Cl2N2O2S/c1-3-14(2)15-9-11-21-20(12-15)30-26(32-21)16-8-10-18(27)19(13-16)29-25(31)24-23(28)17-6-4-5-7-22(17)33-24/h4-14H,3H2,1-2H3,(H,29,31)