N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4-propan-2-yloxy-benzamide Openeye Name: 4-isopropoxy-N-[5-[(3-nitrophenyl)methyl]thiazol-2-yl]benzamide CAS Name: N-[5-[(3-nitrophenyl)methyl]-2-thiazolyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4-propan-2-yloxybenzamide Traditional Name: 4-isopropoxy-N-[5-(3-nitrobenzyl)thiazol-2-yl]benzamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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