4-(aziridin-1-yl)-8-methylsulfanyl-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidine

Systemtic Name: 4-(aziridin-1-yl)-8-methylsulfanyl-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidine Openeye Name: 4-(aziridin-1-yl)-8-methylsulfanyl-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidine CAS Name: 4-(1-aziridinyl)-8-(methylthio)-2-(1-piperazinyl)pyrimido[5,4-d]pyrimidine IUPAC Name: 4-(aziridin-1-yl)-8-methylsulfanyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidine Traditional Name: 4-ethylenimino-8-(methylthio)-2-piperazino-pyrimido[5,4-d]pyrimidine Formula: C13H17N7S MolecularWeight: 303.38598

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NC2=C1N=C(N=C2N3CC3)N4CCNCC4

Isomeric SMILES

CSC1=NC=NC2=C1N=C(N=C2N3CC3)N4CCNCC4

InChI

InChI=1S/C13H17N7S/c1-21-12-10-9(15-8-16-12)11(19-6-7-19)18-13(17-10)20-4-2-14-3-5-20/h8,14H,2-7H2,1H3