5,6-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[3-(4-methylphenoxy)propylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[3-(4-methylphenoxy)propylthio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCSC2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)OCCCSC2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C18H20N2O2S2/c1-11-5-7-14(8-6-11)22-9-4-10-23-18-19-16(21)15-12(2)13(3)24-17(15)20-18/h5-8H,4,9-10H2,1-3H3,(H,19,20,21)