4-(1-oxidanylidene-1,4-thiazinan-4-yl)-N-(phenylmethyl)-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidin-8-amine

Systemtic Name: 4-(1-oxidanylidene-1,4-thiazinan-4-yl)-N-(phenylmethyl)-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidin-8-amine Openeye Name: N-benzyl-4-(1-oxo-1,4-thiazinan-4-yl)-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidin-8-amine CAS Name: 4-(1-oxo-1,4-thiazinan-4-yl)-N-(phenylmethyl)-2-(1-piperazinyl)-8-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-benzyl-4-(1-oxo-1,4-thiazinan-4-yl)-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-8-amine Traditional Name: benzyl-[4-(1-keto-1,4-thiazinan-4-yl)-2-piperazino-pyrimido[5,4-d]pyrimidin-8-yl]amine Formula: C21H26N8OS MolecularWeight: 438.54914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCS(=O)CC4)N=CN=C3NCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCS(=O)CC4)N=CN=C3NCC5=CC=CC=C5

InChI

InChI=1S/C21H26N8OS/c30-31-12-10-28(11-13-31)20-18-17(26-21(27-20)29-8-6-22-7-9-29)19(25-15-24-18)23-14-16-4-2-1-3-5-16/h1-5,15,22H,6-14H2,(H,23,24,25)