6-ethoxy-2-[3-(4-nitrophenyl)prop-2-enylsulfanyl]-1,3-benzothiazole

Systemtic Name: 6-ethoxy-2-[3-(4-nitrophenyl)prop-2-enylsulfanyl]-1,3-benzothiazole Openeye Name: 6-ethoxy-2-[3-(4-nitrophenyl)allylsulfanyl]-1,3-benzothiazole CAS Name: 6-ethoxy-2-[3-(4-nitrophenyl)prop-2-enylthio]-1,3-benzothiazole IUPAC Name: 6-ethoxy-2-[3-(4-nitrophenyl)prop-2-enylsulfanyl]-1,3-benzothiazole Traditional Name: 6-ethoxy-2-[3-(4-nitrophenyl)allylthio]-1,3-benzothiazole Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC=CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O3S2/c1-2-23-15-9-10-16-17(12-15)25-18(19-16)24-11-3-4-13-5-7-14(8-6-13)20(21)22/h3-10,12H,2,11H2,1H3