N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-[4-(3-nitrophenyl)thiazol-2-yl]acetamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-[4-(3-nitrophenyl)thiazol-2-yl]acetamide Formula: C20H19N3O3S2 MolecularWeight: 413.51316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3S2/c1-13(2)28-17-8-6-14(7-9-17)10-19(24)22-20-21-18(12-27-20)15-4-3-5-16(11-15)23(25)26/h3-9,11-13H,10H2,1-2H3,(H,21,22,24)