2,5,6-trimethyl-4-[(4-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidine

Systemtic Name: 2,5,6-trimethyl-4-[(4-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidine Openeye Name: 2,5,6-trimethyl-4-[(4-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidine CAS Name: 2,5,6-trimethyl-4-[(4-nitrophenyl)methylthio]thieno[2,3-d]pyrimidine IUPAC Name: 2,5,6-trimethyl-4-[(4-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidine Traditional Name: 2,5,6-trimethyl-4-[(4-nitrobenzyl)thio]thieno[2,3-d]pyrimidine Formula: C16H15N3O2S2 MolecularWeight: 345.4392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C)SCC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C)SCC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H15N3O2S2/c1-9-10(2)23-16-14(9)15(17-11(3)18-16)22-8-12-4-6-13(7-5-12)19(20)21/h4-7H,8H2,1-3H3