ethyl N-[6-[4-(4-methylpiperazin-1-yl)carbonylimidazol-1-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]carbamate

Systemtic Name: ethyl N-[6-[4-(4-methylpiperazin-1-yl)carbonylimidazol-1-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]carbamate Openeye Name: ethyl N-[6-[4-(4-methylpiperazine-1-carbonyl)imidazol-1-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[4-[(4-methyl-1-piperazinyl)-oxomethyl]-1-imidazolyl]-4-(2-pyrimidinyl)-1H-benzimidazol-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-[4-(4-methylpiperazine-1-carbonyl)imidazol-1-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[4-(4-methylpiperazine-1-carbonyl)imidazol-1-yl]-4-(2-pyrimidyl)-1H-benzimidazol-2-yl]carbamic acid ethyl ester Formula: C23H25N9O3 MolecularWeight: 475.5031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(N1)C=C(C=C2C3=NC=CC=N3)N4C=C(N=C4)C(=O)N5CCN(CC5)C

Isomeric SMILES

CCOC(=O)NC1=NC2=C(N1)C=C(C=C2C3=NC=CC=N3)N4C=C(N=C4)C(=O)N5CCN(CC5)C

InChI

InChI=1S/C23H25N9O3/c1-3-35-23(34)29-22-27-17-12-15(11-16(19(17)28-22)20-24-5-4-6-25-20)32-13-18(26-14-32)21(33)31-9-7-30(2)8-10-31/h4-6,11-14H,3,7-10H2,1-2H3,(H2,27,28,29,34)