1-tert-butyl-2-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]diazane

Systemtic Name: 1-tert-butyl-2-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]diazane Openeye Name: 1-tert-butyl-2-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]hydrazine CAS Name: 1-tert-butyl-2-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]hydrazine IUPAC Name: 1-tert-butyl-2-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]hydrazine Traditional Name: 1-tert-butyl-2-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]hydrazine Formula: C18H25N7O2 MolecularWeight: 371.4368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H25N7O2/c1-18(2,3)22-21-16-15(25(26)27)17(20-13-19-16)24-11-9-23(10-12-24)14-7-5-4-6-8-14/h4-8,13,22H,9-12H2,1-3H3,(H,19,20,21)