6-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-N-cyclohexyl-5-nitro-2-piperazin-1-yl-pyrimidin-4-amine

Systemtic Name: 6-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-N-cyclohexyl-5-nitro-2-piperazin-1-yl-pyrimidin-4-amine Openeye Name: N-cyclohexyl-6-(1,1-dioxo-1,4-thiazinan-4-yl)-5-nitro-2-piperazin-1-yl-pyrimidin-4-amine CAS Name: N-cyclohexyl-6-(1,1-dioxo-1,4-thiazinan-4-yl)-5-nitro-2-(1-piperazinyl)-4-pyrimidinamine IUPAC Name: N-cyclohexyl-6-(1,1-dioxo-1,4-thiazinan-4-yl)-5-nitro-2-piperazin-1-ylpyrimidin-4-amine Traditional Name: cyclohexyl-[6-(1,1-diketo-1,4-thiazinan-4-yl)-5-nitro-2-piperazino-pyrimidin-4-yl]amine Formula: C18H29N7O4S MolecularWeight: 439.53236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC(=C2[N+](=O)[O-])N3CCS(=O)(=O)CC3)N4CCNCC4

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC(=C2[N+](=O)[O-])N3CCS(=O)(=O)CC3)N4CCNCC4

InChI

InChI=1S/C18H29N7O4S/c26-25(27)15-16(20-14-4-2-1-3-5-14)21-18(24-8-6-19-7-9-24)22-17(15)23-10-12-30(28,29)13-11-23/h14,19H,1-13H2,(H,20,21,22)