(5E)-6-[hydroxymethyl(phenethyl)amino]-5-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)pyrimidin-4-one

Systemtic Name: (5E)-6-[hydroxymethyl(phenethyl)amino]-5-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)pyrimidin-4-one Openeye Name: (5E)-6-[hydroxymethyl(phenethyl)amino]-5-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)pyrimidin-4-one CAS Name: (5E)-6-[hydroxymethyl(phenethyl)amino]-5-[6-(1-imidazolyl)-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]-4-pyrimidinone IUPAC Name: (5E)-6-[hydroxymethyl(phenethyl)amino]-5-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)pyrimidin-4-one Traditional Name: (5E)-5-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-6-[methylol(phenethyl)amino]pyrimidin-4-one Formula: C24H23N7O2 MolecularWeight: 441.48512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=NC=NC3=O)N(CCC4=CC=CC=C4)CO)N2)N5C=CN=C5

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C/3\C(=NC=NC3=O)N(CCC4=CC=CC=C4)CO)/N2)N5C=CN=C5

InChI

InChI=1S/C24H23N7O2/c1-16-11-18(30-10-8-25-14-30)12-19-21(16)29-22(28-19)20-23(26-13-27-24(20)33)31(15-32)9-7-17-5-3-2-4-6-17/h2-6,8,10-14,28-29,32H,7,9,15H2,1H3/b22-20+