N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-[4-[(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)carbamoyl]phenoxy]benzamide

Systemtic Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-[4-[(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)carbamoyl]phenoxy]benzamide Openeye Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-[4-[(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)carbamoyl]phenoxy]benzamide CAS Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-[4-[[(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]-oxomethyl]phenoxy]benzamide IUPAC Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-[4-[(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)carbamoyl]phenoxy]benzamide Traditional Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-4-[4-[(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)carbamoyl]phenoxy]benzamide Formula: C32H24N6O7S2 MolecularWeight: 668.69896

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)N=C5N(C6=C(S5)C=C(C=C6)[N+](=O)[O-])CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)N=C5N(C6=C(S5)C=C(C=C6)[N+](=O)[O-])CC

InChI

InChI=1S/C32H24N6O7S2/c1-3-35-25-15-9-21(37(41)42)17-27(25)46-31(35)33-29(39)19-5-11-23(12-6-19)45-24-13-7-20(8-14-24)30(40)34-32-36(4-2)26-16-10-22(38(43)44)18-28(26)47-32/h5-18H,3-4H2,1-2H3