2,4-bis(methylsulfanyl)-7-(4-phenylpiperazin-1-yl)pyrimido[4,5-d]pyrimidine

Systemtic Name: 2,4-bis(methylsulfanyl)-7-(4-phenylpiperazin-1-yl)pyrimido[4,5-d]pyrimidine Openeye Name: 2,4-bis(methylsulfanyl)-7-(4-phenylpiperazin-1-yl)pyrimido[4,5-d]pyrimidine CAS Name: 2,4-bis(methylthio)-7-(4-phenyl-1-piperazinyl)pyrimido[4,5-d]pyrimidine IUPAC Name: 2,4-bis(methylsulfanyl)-7-(4-phenylpiperazin-1-yl)pyrimido[4,5-d]pyrimidine Traditional Name: 2,4-bis(methylthio)-7-(4-phenylpiperazino)pyrimido[4,5-d]pyrimidine Formula: C18H20N6S2 MolecularWeight: 384.5216

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=NC(=NC=C21)N3CCN(CC3)C4=CC=CC=C4)SC

Isomeric SMILES

CSC1=NC(=NC2=NC(=NC=C21)N3CCN(CC3)C4=CC=CC=C4)SC

InChI

InChI=1S/C18H20N6S2/c1-25-16-14-12-19-17(20-15(14)21-18(22-16)26-2)24-10-8-23(9-11-24)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3