N-[4-(3,4-dimethylphenyl)-5-(4-methylphenyl)-1,3-thiazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)-5-(4-methylphenyl)-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[4-(3,4-dimethylphenyl)-5-(p-tolyl)thiazol-2-yl]-3-nitro-benzamide CAS Name: N-[4-(3,4-dimethylphenyl)-5-(4-methylphenyl)-2-thiazolyl]-3-nitrobenzamide IUPAC Name: N-[4-(3,4-dimethylphenyl)-5-(4-methylphenyl)-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[4-(3,4-dimethylphenyl)-5-(p-tolyl)thiazol-2-yl]-3-nitro-benzamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C25H21N3O3S/c1-15-7-10-18(11-8-15)23-22(19-12-9-16(2)17(3)13-19)26-25(32-23)27-24(29)20-5-4-6-21(14-20)28(30)31/h4-14H,1-3H3,(H,26,27,29)