naphthalen-1-yl-[3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methanone

Systemtic Name: naphthalen-1-yl-[3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methanone Openeye Name: 1-naphthyl-[3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methanone CAS Name: 1-naphthalenyl-[3-[(4-nitrophenyl)methylthio]-1,2,4-triazol-4-yl]methanone IUPAC Name: naphthalen-1-yl-[3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methanone Traditional Name: 1-naphthyl-[3-[(4-nitrobenzyl)thio]-1,2,4-triazol-4-yl]methanone Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)N3C=NN=C3SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)N3C=NN=C3SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O3S/c25-19(18-7-3-5-15-4-1-2-6-17(15)18)23-13-21-22-20(23)28-12-14-8-10-16(11-9-14)24(26)27/h1-11,13H,12H2