[1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]pyrrolidin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]pyrrolidin-2-yl]-piperidin-1-yl-methanone Openeye Name: [1-[6-(3-bromoanilino)pyrimidin-4-yl]pyrrolidin-2-yl]-(1-piperidyl)methanone CAS Name: [1-[6-(3-bromoanilino)-4-pyrimidinyl]-2-pyrrolidinyl]-(1-piperidinyl)methanone IUPAC Name: [1-[6-(3-bromoanilino)pyrimidin-4-yl]pyrrolidin-2-yl]-piperidin-1-ylmethanone Traditional Name: [1-[6-(3-bromoanilino)pyrimidin-4-yl]pyrrolidin-2-yl]-piperidino-methanone Formula: C20H24BrN5O MolecularWeight: 430.34146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCCN2C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCCN2C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C20H24BrN5O/c21-15-6-4-7-16(12-15)24-18-13-19(23-14-22-18)26-11-5-8-17(26)20(27)25-9-2-1-3-10-25/h4,6-7,12-14,17H,1-3,5,8-11H2,(H,22,23,24)