4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-5-nitro-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-6-pyrrolidino-pyrimidine Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC=NC(=C3[N+](=O)[O-])N4CCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC=NC(=C3[N+](=O)[O-])N4CCCC4)C

InChI

InChI=1S/C20H26N6O2/c1-15-6-5-7-17(16(15)2)23-10-12-25(13-11-23)20-18(26(27)28)19(21-14-22-20)24-8-3-4-9-24/h5-7,14H,3-4,8-13H2,1-2H3