3-azanyl-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazino]propylthio]thieno[2,3-d]pyrimidin-4-one Formula: C20H25N5O2S2 MolecularWeight: 431.5748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCSC3=NC4=C(C=CS4)C(=O)N3N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCSC3=NC4=C(C=CS4)C(=O)N3N

InChI

InChI=1S/C20H25N5O2S2/c1-27-17-6-3-2-5-16(17)24-11-9-23(10-12-24)8-4-13-29-20-22-18-15(7-14-28-18)19(26)25(20)21/h2-3,5-7,14H,4,8-13,21H2,1H3