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

Systemtic Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-phenylpiperazin-1-yl)phenyl]sulfonyl-phenyl]-4-phenyl-piperazine Openeye Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-phenylpiperazin-1-yl)phenyl]sulfonyl-phenyl]-4-phenyl-piperazine CAS Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-phenyl-1-piperazinyl)phenyl]sulfonylphenyl]-4-phenylpiperazine IUPAC Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-phenylpiperazin-1-yl)phenyl]sulfonylphenyl]-4-phenylpiperazine Traditional Name: 1-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-phenylpiperazino)phenyl]sulfonyl-phenyl]-4-phenyl-piperazine Formula: C34H32N6O2S3 MolecularWeight: 652.85188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)N5CCN(CC5)C6=CC=CC=C6)N=C=S)N=C=S

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)N5CCN(CC5)C6=CC=CC=C6)N=C=S)N=C=S

InChI

InChI=1S/C34H32N6O2S3/c41-45(42,29-11-13-33(31(23-29)35-25-43)39-19-15-37(16-20-39)27-7-3-1-4-8-27)30-12-14-34(32(24-30)36-26-44)40-21-17-38(18-22-40)28-9-5-2-6-10-28/h1-14,23-24H,15-22H2