3-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylthio]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one IUPAC Name: 3-(4-ethoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(4-nitrobenzyl)thio]-3-p-phenetyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(CCS3)N=C2SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(CCS3)N=C2SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4S2/c1-2-28-17-9-7-15(8-10-17)23-20(25)19-18(11-12-29-19)22-21(23)30-13-14-3-5-16(6-4-14)24(26)27/h3-10H,2,11-13H2,1H3