2-(dimethylamino)-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-[4-(4-methoxyphenyl)-5-methyl-2-thiazolyl]-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]-5-nitro-benzamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H20N4O4S/c1-12-18(13-5-8-15(28-4)9-6-13)21-20(29-12)22-19(25)16-11-14(24(26)27)7-10-17(16)23(2)3/h5-11H,1-4H3,(H,21,22,25)