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

Systemtic Name: 4-(4-chlorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-[(4-nitrophenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-[(4-nitrobenzyl)thio]-5-(2-thienyl)-1,2,4-triazole Formula: C19H13ClN4O2S2 MolecularWeight: 428.91512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13ClN4O2S2/c20-14-5-9-15(10-6-14)23-18(17-2-1-11-27-17)21-22-19(23)28-12-13-3-7-16(8-4-13)24(25)26/h1-11H,12H2