3,6-bis[bis[(4-methylphenyl)sulfanyl]methylidene]piperazine-2,5-dione

Systemtic Name: 3,6-bis[bis[(4-methylphenyl)sulfanyl]methylidene]piperazine-2,5-dione Openeye Name: 3,6-bis[bis(p-tolylsulfanyl)methylene]piperazine-2,5-dione CAS Name: 3,6-bis[bis[(4-methylphenyl)thio]methylidene]piperazine-2,5-dione IUPAC Name: 3,6-bis[bis[(4-methylphenyl)sulfanyl]methylidene]piperazine-2,5-dione Traditional Name: 3,6-bis[bis(p-tolylthio)methylene]piperazine-2,5-quinone Formula: C34H30N2O2S4 MolecularWeight: 626.8742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=C2C(=O)NC(=C(SC3=CC=C(C=C3)C)SC4=CC=C(C=C4)C)C(=O)N2)SC5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(=C2C(=O)NC(=C(SC3=CC=C(C=C3)C)SC4=CC=C(C=C4)C)C(=O)N2)SC5=CC=C(C=C5)C

InChI

InChI=1S/C34H30N2O2S4/c1-21-5-13-25(14-6-21)39-33(40-26-15-7-22(2)8-16-26)29-31(37)36-30(32(38)35-29)34(41-27-17-9-23(3)10-18-27)42-28-19-11-24(4)12-20-28/h5-20H,1-4H3,(H,35,38)(H,36,37)