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

Systemtic Name: N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-[2-(4-methoxyphenyl)thiazol-4-yl]ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-[2-(4-methoxyphenyl)-4-thiazolyl]ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[2-(4-methoxyphenyl)thiazol-4-yl]ethyl]-4-methyl-3-nitro-benzamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC2=CSC(=N2)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC2=CSC(=N2)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4S/c1-13-3-4-15(11-18(13)23(25)26)19(24)21-10-9-16-12-28-20(22-16)14-5-7-17(27-2)8-6-14/h3-8,11-12H,9-10H2,1-2H3,(H,21,24)