N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C14H12N6O3S2 MolecularWeight: 376.41348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC=NN3

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC=NN3

InChI

InChI=1S/C14H12N6O3S2/c1-8(25-13-15-7-16-19-13)12(21)18-14-17-11(6-24-14)9-3-2-4-10(5-9)20(22)23/h2-8H,1H3,(H,15,16,19)(H,17,18,21)