(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]methanone

Systemtic Name: (4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(2-naphthylsulfonyl)piperazin-1-yl]-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]methanone CAS Name: [4-(2-naphthalenylsulfonyl)-1-piperazinyl]-[4-[(1H-1,2,4-triazol-5-ylthio)methyl]phenyl]methanone IUPAC Name: (4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]methanone Traditional Name: [4-(2-naphthylsulfonyl)piperazino]-[4-[(1H-1,2,4-triazol-5-ylthio)methyl]phenyl]methanone Formula: C24H23N5O3S2 MolecularWeight: 493.60112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)CSC3=NC=NN3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)CSC3=NC=NN3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H23N5O3S2/c30-23(20-7-5-18(6-8-20)16-33-24-25-17-26-27-24)28-11-13-29(14-12-28)34(31,32)22-10-9-19-3-1-2-4-21(19)15-22/h1-10,15,17H,11-14,16H2,(H,25,26,27)