N7,N7-diethyl-N4-(phenylmethyl)-2-(phenylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-4,7-diamine

Systemtic Name: N7,N7-diethyl-N4-(phenylmethyl)-2-(phenylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-4,7-diamine Openeye Name: N4-benzyl-2-benzylsulfanyl-N7,N7-diethyl-pyrimido[4,5-d]pyrimidine-4,7-diamine CAS Name: N7,N7-diethyl-N4-(phenylmethyl)-2-(phenylmethylthio)pyrimido[4,5-d]pyrimidine-4,7-diamine IUPAC Name: 4-N-benzyl-2-benzylsulfanyl-7-N,7-N-diethylpyrimido[4,5-d]pyrimidine-4,7-diamine Traditional Name: [4-(benzylamino)-2-(benzylthio)pyrimido[4,5-d]pyrimidin-7-yl]-diethyl-amine Formula: C24H26N6S MolecularWeight: 430.56844

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=C2C(=N1)N=C(N=C2NCC3=CC=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C1=NC=C2C(=N1)N=C(N=C2NCC3=CC=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C24H26N6S/c1-3-30(4-2)23-26-16-20-21(25-15-18-11-7-5-8-12-18)28-24(29-22(20)27-23)31-17-19-13-9-6-10-14-19/h5-14,16H,3-4,15,17H2,1-2H3,(H,25,26,27,28,29)