2-[(4-tert-butylphenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine CAS Name: 2-[(4-tert-butylphenyl)methylthio]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine Traditional Name: 2-[(4-tert-butylbenzyl)thio]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine Formula: C23H24N2S2 MolecularWeight: 392.58006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C23H24N2S2/c1-15-5-10-20-19(11-15)21-17(14-26-20)12-24-22(25-21)27-13-16-6-8-18(9-7-16)23(2,3)4/h5-12H,13-14H2,1-4H3