4-(2-chloranyl-8-octylsulfanyl-pyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide

Systemtic Name: 4-(2-chloranyl-8-octylsulfanyl-pyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide Openeye Name: 4-(2-chloro-8-octylsulfanyl-pyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide CAS Name: 4-[2-chloro-8-(octylthio)-4-pyrimido[5,4-d]pyrimidinyl]-1,4-thiazinane 1-oxide IUPAC Name: 4-(2-chloro-8-octylsulfanylpyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide Traditional Name: 4-[2-chloro-8-(octylthio)pyrimido[5,4-d]pyrimidin-4-yl]-1,4-thiazinane 1-oxide Formula: C18H26ClN5OS2 MolecularWeight: 428.01494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC=NC2=C1N=C(N=C2N3CCS(=O)CC3)Cl

Isomeric SMILES

CCCCCCCCSC1=NC=NC2=C1N=C(N=C2N3CCS(=O)CC3)Cl

InChI

InChI=1S/C18H26ClN5OS2/c1-2-3-4-5-6-7-10-26-17-15-14(20-13-21-17)16(23-18(19)22-15)24-8-11-27(25)12-9-24/h13H,2-12H2,1H3