5-(4-fluoranyl-3-methyl-phenyl)-2-methoxy-4-[4-(4-methyl-3H-pyrrol-5-yl)piperidin-1-yl]pyrimidine

Systemtic Name: 5-(4-fluoranyl-3-methyl-phenyl)-2-methoxy-4-[4-(4-methyl-3H-pyrrol-5-yl)piperidin-1-yl]pyrimidine Openeye Name: 5-(4-fluoro-3-methyl-phenyl)-2-methoxy-4-[4-(4-methyl-3H-pyrrol-5-yl)-1-piperidyl]pyrimidine CAS Name: 5-(4-fluoro-3-methylphenyl)-2-methoxy-4-[4-(4-methyl-3H-pyrrol-5-yl)-1-piperidinyl]pyrimidine IUPAC Name: 5-(4-fluoro-3-methylphenyl)-2-methoxy-4-[4-(4-methyl-3H-pyrrol-5-yl)piperidin-1-yl]pyrimidine Traditional Name: 5-(4-fluoro-3-methyl-phenyl)-2-methoxy-4-[4-(4-methyl-3H-pyrrol-5-yl)piperidino]pyrimidine Formula: C22H25FN4O MolecularWeight: 380.458503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC1)C2CCN(CC2)C3=NC(=NC=C3C4=CC(=C(C=C4)F)C)OC

Isomeric SMILES

CC1=C(N=CC1)C2CCN(CC2)C3=NC(=NC=C3C4=CC(=C(C=C4)F)C)OC

InChI

InChI=1S/C22H25FN4O/c1-14-6-9-24-20(14)16-7-10-27(11-8-16)21-18(13-25-22(26-21)28-3)17-4-5-19(23)15(2)12-17/h4-5,9,12-13,16H,6-8,10-11H2,1-3H3