2-[[5-(4-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-yloxyphenyl)ethanamide

Systemtic Name: 2-[[5-(4-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-yloxyphenyl)ethanamide Openeye Name: N-(2-isopropoxyphenyl)-2-[[5-(4-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(4-nitrophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-propan-2-yloxyphenyl)acetamide IUPAC Name: 2-[[5-(4-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxyphenyl)-2-[[5-(4-nitrophenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4S/c1-12(2)28-16-6-4-3-5-15(16)20-17(25)11-29-19-21-18(22-23-19)13-7-9-14(10-8-13)24(26)27/h3-10,12H,11H2,1-2H3,(H,20,25)(H,21,22,23)