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

Systemtic Name: N-[2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]-3-nitro-benzamide Openeye Name: N-[2-[2-(4-methoxyphenyl)-4-methyl-thiazol-5-yl]ethyl]-3-nitro-benzamide CAS Name: N-[2-[2-(4-methoxyphenyl)-4-methyl-5-thiazolyl]ethyl]-3-nitrobenzamide IUPAC Name: N-[2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]-3-nitrobenzamide Traditional Name: N-[2-[2-(4-methoxyphenyl)-4-methyl-thiazol-5-yl]ethyl]-3-nitro-benzamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)OC)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)OC)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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