N-(1,3-benzothiazol-2-yl)-N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[3,5-bis(trifluoromethyl)phenyl]-4-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[3,5-bis(trifluoromethyl)phenyl]-4-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzamide Formula: C22H11F6N3O3S MolecularWeight: 511.396459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)N(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H11F6N3O3S/c23-21(24,25)13-9-14(22(26,27)28)11-16(10-13)30(20-29-17-3-1-2-4-18(17)35-20)19(32)12-5-7-15(8-6-12)31(33)34/h1-11H