2,3,5-triphenyl-4-phenylsulfanyl-3,4-dihydropyrazole

Systemtic Name: 2,3,5-triphenyl-4-phenylsulfanyl-3,4-dihydropyrazole Openeye Name: 2,3,5-triphenyl-4-phenylsulfanyl-3,4-dihydropyrazole CAS Name: 2,3,5-triphenyl-4-(phenylthio)-3,4-dihydropyrazole IUPAC Name: 2,3,5-triphenyl-4-phenylsulfanyl-3,4-dihydropyrazole Traditional Name: 1,3,5-triphenyl-4-(phenylthio)-2-pyrazoline Formula: C27H22N2S MolecularWeight: 406.54198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2C(C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C27H22N2S/c1-5-13-21(14-6-1)25-27(30-24-19-11-4-12-20-24)26(22-15-7-2-8-16-22)29(28-25)23-17-9-3-10-18-23/h1-20,26-27H