(8-chloranyl-1,2-dimethyl-6-pyrimidin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-yl) ethanoate

Systemtic Name: (8-chloranyl-1,2-dimethyl-6-pyrimidin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-yl) ethanoate Openeye Name: (8-chloro-1,2-dimethyl-6-pyrimidin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-yl) acetate CAS Name: acetic acid [8-chloro-1,2-dimethyl-6-(2-pyrimidinyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-4-yl] ester IUPAC Name: (8-chloro-1,2-dimethyl-6-pyrimidin-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-yl) acetate Traditional Name: acetic acid [8-chloro-1,2-dimethyl-6-(2-pyrimidyl)-4H-imidazo[1,2-a][1,4]benzodiazepin-4-yl] ester Formula: C19H16ClN5O2 MolecularWeight: 381.81564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(C=C(C=C3)Cl)C(=NC(C2=N1)OC(=O)C)C4=NC=CC=N4)C

Isomeric SMILES

CC1=C(N2C3=C(C=C(C=C3)Cl)C(=NC(C2=N1)OC(=O)C)C4=NC=CC=N4)C

InChI

InChI=1S/C19H16ClN5O2/c1-10-11(2)25-15-6-5-13(20)9-14(15)16(17-21-7-4-8-22-17)24-19(18(25)23-10)27-12(3)26/h4-9,19H,1-3H3