N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-nitro-benzamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-4-nitro-benzamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-4-nitrobenzamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-4-nitro-benzamide Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H15N3O5S/c1-25-15-8-5-12(9-16(15)26-2)14-10-27-18(19-14)20-17(22)11-3-6-13(7-4-11)21(23)24/h3-10H,1-2H3,(H,19,20,22)