2-methyl-4-[(Z)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-yl-ethenyl]-5-nitro-6-piperidin-1-yl-pyrimidine

Systemtic Name: 2-methyl-4-[(Z)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-yl-ethenyl]-5-nitro-6-piperidin-1-yl-pyrimidine Openeye Name: 2-methyl-4-[(Z)-2-(5-methyl-2-furyl)-2-pyrrolidin-1-yl-vinyl]-5-nitro-6-(1-piperidyl)pyrimidine CAS Name: 2-methyl-4-[(Z)-2-(5-methyl-2-furanyl)-2-(1-pyrrolidinyl)ethenyl]-5-nitro-6-(1-piperidinyl)pyrimidine IUPAC Name: 2-methyl-4-[(Z)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethenyl]-5-nitro-6-piperidin-1-ylpyrimidine Traditional Name: 2-methyl-4-[(Z)-2-(5-methyl-2-furyl)-2-pyrrolidino-vinyl]-5-nitro-6-piperidino-pyrimidine Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=CC2=C(C(=NC(=N2)C)N3CCCCC3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

CC1=CC=C(O1)/C(=C/C2=C(C(=NC(=N2)C)N3CCCCC3)[N+](=O)[O-])/N4CCCC4

InChI

InChI=1S/C21H27N5O3/c1-15-8-9-19(29-15)18(24-10-6-7-11-24)14-17-20(26(27)28)21(23-16(2)22-17)25-12-4-3-5-13-25/h8-9,14H,3-7,10-13H2,1-2H3/b18-14-