5,6-dimethyl-4-[2-(5-methyl-2-nitro-phenoxy)ethylsulfanyl]thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-4-[2-(5-methyl-2-nitro-phenoxy)ethylsulfanyl]thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-4-[2-(5-methyl-2-nitro-phenoxy)ethylsulfanyl]thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-4-[2-(5-methyl-2-nitrophenoxy)ethylthio]thieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-4-[2-(5-methyl-2-nitrophenoxy)ethylsulfanyl]thieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-4-[2-(5-methyl-2-nitro-phenoxy)ethylthio]thieno[2,3-d]pyrimidine Formula: C17H17N3O3S2 MolecularWeight: 375.46518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCCSC2=NC=NC3=C2C(=C(S3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCCSC2=NC=NC3=C2C(=C(S3)C)C

InChI

InChI=1S/C17H17N3O3S2/c1-10-4-5-13(20(21)22)14(8-10)23-6-7-24-16-15-11(2)12(3)25-17(15)19-9-18-16/h4-5,8-9H,6-7H2,1-3H3