N-methyl-N-[(2-nitrophenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-methyl-N-[(2-nitrophenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-methyl-N-[(2-nitrophenyl)methyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-methyl-N-[(2-nitrophenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-methyl-N-[(2-nitrophenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-methyl-N-(2-nitrobenzyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C16H15N5O3S2 MolecularWeight: 389.452

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C16H15N5O3S2/c1-19(9-11-5-2-3-6-12(11)21(23)24)14(22)10-20-15(17-18-16(20)25)13-7-4-8-26-13/h2-8H,9-10H2,1H3,(H,18,25)