6-ethoxy-2-[(6-nitro-1H-indol-3-yl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 6-ethoxy-2-[(6-nitro-1H-indol-3-yl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 6-ethoxy-2-[(6-nitro-1H-indol-3-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 6-ethoxy-2-[(6-nitro-1H-indol-3-yl)methylthio]-1,3-benzothiazole IUPAC Name: 6-ethoxy-2-[(6-nitro-1H-indol-3-yl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 6-ethoxy-2-[(6-nitro-1H-indol-3-yl)methylthio]-1,3-benzothiazole Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC3=CNC4=C3C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC3=CNC4=C3C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3S2/c1-2-24-13-4-6-15-17(8-13)26-18(20-15)25-10-11-9-19-16-7-12(21(22)23)3-5-14(11)16/h3-9,19H,2,10H2,1H3