1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-methylpiperazin-1-yl)phenyl]sulfonyl-phenyl]-4-methyl-piperazine

Systemtic Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-methylpiperazin-1-yl)phenyl]sulfonyl-phenyl]-4-methyl-piperazine Openeye Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-methylpiperazin-1-yl)phenyl]sulfonyl-phenyl]-4-methyl-piperazine CAS Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-methyl-1-piperazinyl)phenyl]sulfonylphenyl]-4-methylpiperazine IUPAC Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-methylpiperazin-1-yl)phenyl]sulfonylphenyl]-4-methylpiperazine Traditional Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-methylpiperazino)phenyl]sulfonyl-phenyl]-4-methyl-piperazine Formula: C24H28N6O2S3 MolecularWeight: 528.71312

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)N4CCN(CC4)C)N=C=S)N=C=S

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)N4CCN(CC4)C)N=C=S)N=C=S

InChI

InChI=1S/C24H28N6O2S3/c1-27-7-11-29(12-8-27)23-5-3-19(15-21(23)25-17-33)35(31,32)20-4-6-24(22(16-20)26-18-34)30-13-9-28(2)10-14-30/h3-6,15-16H,7-14H2,1-2H3