N-[4-[4-(2-methoxyethyl)phenyl]-1,3-thiazol-2-yl]-2-(methylamino)-5-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)CCOC

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)CCOC

InChI

InChI=1S/C20H20N4O4S/c1-21-17-8-7-15(24(26)27)11-16(17)19(25)23-20-22-18(12-29-20)14-5-3-13(4-6-14)9-10-28-2/h3-8,11-12,21H,9-10H2,1-2H3,(H,22,23,25)