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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H21ClN2O2S/c1-3-15(2)17-10-13-21-20(14-17)29-26(31-21)16-8-11-18(12-9-16)28-25(30)24-23(27)19-6-4-5-7-22(19)32-24/h4-15H,3H2,1-2H3,(H,28,30)