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

Systemtic Name: 1-tert-butyl-2-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]diazane Openeye Name: 1-tert-butyl-2-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]hydrazine CAS Name: 1-tert-butyl-2-[6-[4-(4-methoxyphenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]hydrazine IUPAC Name: 1-tert-butyl-2-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]hydrazine Traditional Name: 1-tert-butyl-2-[6-[4-(4-methoxyphenyl)piperazino]-5-nitro-pyrimidin-4-yl]hydrazine Formula: C19H27N7O3 MolecularWeight: 401.46278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N7O3/c1-19(2,3)23-22-17-16(26(27)28)18(21-13-20-17)25-11-9-24(10-12-25)14-5-7-15(29-4)8-6-14/h5-8,13,23H,9-12H2,1-4H3,(H,20,21,22)