1-[(4-tert-butylphenyl)methylsulfanyl]-4-phenyl-phthalazine

Systemtic Name: 1-[(4-tert-butylphenyl)methylsulfanyl]-4-phenyl-phthalazine Openeye Name: 1-[(4-tert-butylphenyl)methylsulfanyl]-4-phenyl-phthalazine CAS Name: 1-[(4-tert-butylphenyl)methylthio]-4-phenylphthalazine IUPAC Name: 1-[(4-tert-butylphenyl)methylsulfanyl]-4-phenylphthalazine Traditional Name: 1-[(4-tert-butylbenzyl)thio]-4-phenyl-phthalazine Formula: C25H24N2S MolecularWeight: 384.53646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2S/c1-25(2,3)20-15-13-18(14-16-20)17-28-24-22-12-8-7-11-21(22)23(26-27-24)19-9-5-4-6-10-19/h4-16H,17H2,1-3H3