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

Systemtic Name: 3-azanyl-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylthio]-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[3-[4-(2-methoxyphenyl)piperazino]propylthio]pyrido[2,3-d]pyrimidin-4-one Formula: C21H26N6O2S MolecularWeight: 426.53514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCSC3=NC4=C(C=CC=N4)C(=O)N3N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCSC3=NC4=C(C=CC=N4)C(=O)N3N

InChI

InChI=1S/C21H26N6O2S/c1-29-18-8-3-2-7-17(18)26-13-11-25(12-14-26)10-5-15-30-21-24-19-16(6-4-9-23-19)20(28)27(21)22/h2-4,6-9H,5,10-15,22H2,1H3