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

Systemtic Name: bis(3-methyl-1,4-diphenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione Openeye Name: bis(3-methyl-1,4-diphenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione CAS Name: bis(3-methyl-1,4-diphenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione IUPAC Name: bis(3-methyl-1,4-diphenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione Traditional Name: bis(3-methyl-1,4-diphenyl-3a,6a-dihydropyrazolo[3,4-c]pyrazol-6-yl)methanethione Formula: C35H30N8S MolecularWeight: 594.7313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2C1C(=NN2C(=S)N3C4C(C(=NN4C5=CC=CC=C5)C)C(=N3)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

CC1=NN(C2C1C(=NN2C(=S)N3C4C(C(=NN4C5=CC=CC=C5)C)C(=N3)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C35H30N8S/c1-23-29-31(25-15-7-3-8-16-25)38-42(33(29)40(36-23)27-19-11-5-12-20-27)35(44)43-34-30(32(39-43)26-17-9-4-10-18-26)24(2)37-41(34)28-21-13-6-14-22-28/h3-22,29-30,33-34H,1-2H3