2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(2-naphthylsulfonyl)piperazin-1-yl]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(2-naphthylsulfonyl)piperazino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C21H21N5O2S3 MolecularWeight: 471.61874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N=C(N2)C3=CC=CS3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1CN2C(=S)N=C(N2)C3=CC=CS3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C21H21N5O2S3/c27-31(28,18-8-7-16-4-1-2-5-17(16)14-18)25-11-9-24(10-12-25)15-26-21(29)22-20(23-26)19-6-3-13-30-19/h1-8,13-14H,9-12,15H2,(H,22,23,29)