4-cyclopropyl-3-[(2-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(2-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(2-nitrophenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(2-nitrophenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(2-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(2-nitrobenzyl)thio]-5-(2-thienyl)-1,2,4-triazole Formula: C16H14N4O2S2 MolecularWeight: 358.43796

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=CC=C3[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=CC=C3[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C16H14N4O2S2/c21-20(22)13-5-2-1-4-11(13)10-24-16-18-17-15(14-6-3-9-23-14)19(16)12-7-8-12/h1-6,9,12H,7-8,10H2