N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-ethoxy-5-methoxy-2-nitro-benzamide

Systemtic Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-ethoxy-5-methoxy-2-nitro-benzamide Openeye Name: N-[5-[(2-chlorophenyl)methyl]thiazol-2-yl]-4-ethoxy-5-methoxy-2-nitro-benzamide CAS Name: N-[5-[(2-chlorophenyl)methyl]-2-thiazolyl]-4-ethoxy-5-methoxy-2-nitrobenzamide IUPAC Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-ethoxy-5-methoxy-2-nitrobenzamide Traditional Name: N-[5-(2-chlorobenzyl)thiazol-2-yl]-4-ethoxy-5-methoxy-2-nitro-benzamide Formula: C20H18ClN3O5S MolecularWeight: 447.89202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NC=C(S2)CC3=CC=CC=C3Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NC=C(S2)CC3=CC=CC=C3Cl)OC

InChI

InChI=1S/C20H18ClN3O5S/c1-3-29-18-10-16(24(26)27)14(9-17(18)28-2)19(25)23-20-22-11-13(30-20)8-12-6-4-5-7-15(12)21/h4-7,9-11H,3,8H2,1-2H3,(H,22,23,25)