1-(2,4-dimethyl-9-nitro-6-pyridin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)-N,N-dimethyl-methanamine

Systemtic Name: 1-(2,4-dimethyl-9-nitro-6-pyridin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)-N,N-dimethyl-methanamine Openeye Name: 1-[2,4-dimethyl-9-nitro-6-(2-pyridyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl]-N,N-dimethyl-methanamine CAS Name: 1-[2,4-dimethyl-9-nitro-6-(2-pyridinyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl]-N,N-dimethylmethanamine IUPAC Name: 1-(2,4-dimethyl-9-nitro-6-pyridin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl)-N,N-dimethylmethanamine Traditional Name: [2,4-dimethyl-9-nitro-6-(2-pyridyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-1-yl]methyl-dimethyl-amine Formula: C21H22N6O2 MolecularWeight: 390.43838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=NC(=C(N2C3=C(C=CC(=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=N4)CN(C)C)C

Isomeric SMILES

CC1C2=NC(=C(N2C3=C(C=CC(=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=N4)CN(C)C)C

InChI

InChI=1S/C21H22N6O2/c1-13-19(12-25(3)4)26-18-11-15(27(28)29)8-9-16(18)20(17-7-5-6-10-22-17)23-14(2)21(26)24-13/h5-11,14H,12H2,1-4H3