bis(3,4-dimethyl-1-phenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione

Systemtic Name: bis(3,4-dimethyl-1-phenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione Openeye Name: bis(3,4-dimethyl-1-phenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione CAS Name: bis(3,4-dimethyl-1-phenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione IUPAC Name: bis(3,4-dimethyl-1-phenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione Traditional Name: bis(3,4-dimethyl-1-phenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione Formula: C25H26N8S MolecularWeight: 470.59254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2C1C(=NN2C(=S)N3C4C(C(=NN4C5=CC=CC=C5)C)C(=N3)C)C)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2C1C(=NN2C(=S)N3C4C(C(=NN4C5=CC=CC=C5)C)C(=N3)C)C)C6=CC=CC=C6

InChI

InChI=1S/C25H26N8S/c1-15-21-17(3)28-32(23(21)30(26-15)19-11-7-5-8-12-19)25(34)33-24-22(18(4)29-33)16(2)27-31(24)20-13-9-6-10-14-20/h5-14,21-24H,1-4H3