1,4-bis[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]piperazine-2,5-dione

Systemtic Name: 1,4-bis[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]piperazine-2,5-dione Openeye Name: 1,4-bis[4-(4-sec-butylphenyl)thiazol-2-yl]piperazine-2,5-dione CAS Name: 1,4-bis[4-(4-butan-2-ylphenyl)-2-thiazolyl]piperazine-2,5-dione IUPAC Name: 1,4-bis[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]piperazine-2,5-dione Traditional Name: 1,4-bis[4-(4-sec-butylphenyl)thiazol-2-yl]piperazine-2,5-quinone Formula: C30H32N4O2S2 MolecularWeight: 544.73068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)N3CC(=O)N(CC3=O)C4=NC(=CS4)C5=CC=C(C=C5)C(C)CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)N3CC(=O)N(CC3=O)C4=NC(=CS4)C5=CC=C(C=C5)C(C)CC

InChI

InChI=1S/C30H32N4O2S2/c1-5-19(3)21-7-11-23(12-8-21)25-17-37-29(31-25)33-15-28(36)34(16-27(33)35)30-32-26(18-38-30)24-13-9-22(10-14-24)20(4)6-2/h7-14,17-20H,5-6,15-16H2,1-4H3