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

Systemtic Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C20H19N3O5S/c1-11-5-6-13(7-12(11)2)15-10-29-20(21-15)22-19(24)14-8-17(27-3)18(28-4)9-16(14)23(25)26/h5-10H,1-4H3,(H,21,22,24)