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

Systemtic Name: 3-chloranyl-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]benzothiophene-2-carboxamide Formula: C26H22ClN3O2S MolecularWeight: 475.98978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22ClN3O2S/c1-3-30(4-2)18-12-9-16(10-13-18)26-29-20-15-17(11-14-21(20)32-26)28-25(31)24-23(27)19-7-5-6-8-22(19)33-24/h5-15H,3-4H2,1-2H3,(H,28,31)