2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-3-nitro-phenyl]-2,3-dihydro-1,3-benzoxazin-4-one

Systemtic Name: 2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-3-nitro-phenyl]-2,3-dihydro-1,3-benzoxazin-4-one Openeye Name: 2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-3-nitro-phenyl]-2,3-dihydro-1,3-benzoxazin-4-one CAS Name: 2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-3-nitrophenyl]-2,3-dihydro-1,3-benzoxazin-4-one IUPAC Name: 2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-3-nitrophenyl]-2,3-dihydro-1,3-benzoxazin-4-one Traditional Name: 2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-3-nitro-phenyl]-2,3-dihydro-1,3-benzoxazin-4-one Formula: C23H17N3O5S2 MolecularWeight: 479.52818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC3=C(C=C(C=C3)C4NC(=O)C5=CC=CC=C5O4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC3=C(C=C(C=C3)C4NC(=O)C5=CC=CC=C5O4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O5S2/c1-2-30-14-8-9-16-20(12-14)33-23(24-16)32-19-10-7-13(11-17(19)26(28)29)22-25-21(27)15-5-3-4-6-18(15)31-22/h3-12,22H,2H2,1H3,(H,25,27)