2-[2-(3-phenylsulfanyl-1H-indol-2-yl)ethyl]-1,3-benzoxazole

Systemtic Name: 2-[2-(3-phenylsulfanyl-1H-indol-2-yl)ethyl]-1,3-benzoxazole Openeye Name: 2-[2-(3-phenylsulfanyl-1H-indol-2-yl)ethyl]-1,3-benzoxazole CAS Name: 2-[2-[3-(phenylthio)-1H-indol-2-yl]ethyl]-1,3-benzoxazole IUPAC Name: 2-[2-(3-phenylsulfanyl-1H-indol-2-yl)ethyl]-1,3-benzoxazole Traditional Name: 2-[2-[3-(phenylthio)-1H-indol-2-yl]ethyl]-1,3-benzoxazole Formula: C23H18N2OS MolecularWeight: 370.46682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(NC3=CC=CC=C32)CCC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(NC3=CC=CC=C32)CCC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C23H18N2OS/c1-2-8-16(9-3-1)27-23-17-10-4-5-11-18(17)24-20(23)14-15-22-25-19-12-6-7-13-21(19)26-22/h1-13,24H,14-15H2