6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-propan-2-yl-pyrimidin-4-amine

Systemtic Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-propan-2-yl-pyrimidin-4-amine Openeye Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-isopropyl-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-5-nitro-N-propan-2-yl-4-pyrimidinamine IUPAC Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-propan-2-ylpyrimidin-4-amine Traditional Name: [6-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-pyrimidin-4-yl]-isopropyl-amine Formula: C19H26N6O2 MolecularWeight: 370.44874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC(C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C19H26N6O2/c1-13(2)22-18-17(25(26)27)19(21-12-20-18)24-10-8-23(9-11-24)16-7-5-6-14(3)15(16)4/h5-7,12-13H,8-11H2,1-4H3,(H,20,21,22)