6-[(2-methylphenyl)methylsulfanyl]-2,4-bis(oxidanylidene)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 6-[(2-methylphenyl)methylsulfanyl]-2,4-bis(oxidanylidene)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 6-(o-tolylmethylsulfanyl)-2,4-dioxo-1H-thieno[3,2-d]pyrimidine-7-carbonitrile CAS Name: 6-[(2-methylphenyl)methylthio]-2,4-dioxo-1H-thieno[3,2-d]pyrimidine-7-carbonitrile IUPAC Name: 6-[(2-methylphenyl)methylsulfanyl]-2,4-dioxo-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 2,4-diketo-6-[(2-methylbenzyl)thio]-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Formula: C15H11N3O2S2 MolecularWeight: 329.39674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C3=C(S2)C(=O)NC(=O)N3)C#N

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C3=C(S2)C(=O)NC(=O)N3)C#N

InChI

InChI=1S/C15H11N3O2S2/c1-8-4-2-3-5-9(8)7-21-14-10(6-16)11-12(22-14)13(19)18-15(20)17-11/h2-5H,7H2,1H3,(H2,17,18,19,20)