3-(4-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-methoxyphenyl)-2-[(3-nitrophenyl)methylthio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(4-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-methoxyphenyl)-2-[(3-nitrobenzyl)thio]thieno[3,2-d]pyrimidin-4-one Formula: C20H15N3O4S2 MolecularWeight: 425.4808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O4S2/c1-27-16-7-5-14(6-8-16)22-19(24)18-17(9-10-28-18)21-20(22)29-12-13-3-2-4-15(11-13)23(25)26/h2-11H,12H2,1H3