[2-phenyl-1-[2-(1-phenylethylamino)pyrimidin-4-yl]imidazol-4-yl]-piperazin-1-yl-methanone

Systemtic Name: [2-phenyl-1-[2-(1-phenylethylamino)pyrimidin-4-yl]imidazol-4-yl]-piperazin-1-yl-methanone Openeye Name: [2-phenyl-1-[2-(1-phenylethylamino)pyrimidin-4-yl]imidazol-4-yl]-piperazin-1-yl-methanone CAS Name: [2-phenyl-1-[2-(1-phenylethylamino)-4-pyrimidinyl]-4-imidazolyl]-(1-piperazinyl)methanone IUPAC Name: [2-phenyl-1-[2-(1-phenylethylamino)pyrimidin-4-yl]imidazol-4-yl]-piperazin-1-ylmethanone Traditional Name: [2-phenyl-1-[2-(1-phenylethylamino)pyrimidin-4-yl]imidazol-4-yl]-piperazino-methanone Formula: C26H27N7O MolecularWeight: 453.53888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=C(N=C3C4=CC=CC=C4)C(=O)N5CCNCC5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=C(N=C3C4=CC=CC=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C26H27N7O/c1-19(20-8-4-2-5-9-20)29-26-28-13-12-23(31-26)33-18-22(25(34)32-16-14-27-15-17-32)30-24(33)21-10-6-3-7-11-21/h2-13,18-19,27H,14-17H2,1H3,(H,28,29,31)