N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide Formula: C25H19N5O3S MolecularWeight: 469.51506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=C(C=C4)N5C=CN=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=C(C=C4)N5C=CN=C5)[N+](=O)[O-])C

InChI

InChI=1S/C25H19N5O3S/c1-16-11-17(2)13-19(12-16)29(25-27-20-5-3-4-6-23(20)34-25)24(31)18-7-8-21(22(14-18)30(32)33)28-10-9-26-15-28/h3-15H,1-2H3