2-[1-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[1-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[1-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[1-(1,3-benzothiazol-2-ylthio)ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[1-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[1-(1,3-benzothiazol-2-ylthio)ethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Formula: C17H12N4O3S2 MolecularWeight: 384.43218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12N4O3S2/c1-10(25-17-18-13-4-2-3-5-14(13)26-17)15-19-20-16(24-15)11-6-8-12(9-7-11)21(22)23/h2-10H,1H3