8-bromanyl-4-[4-(phenylmethyl)piperidin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 8-bromanyl-4-[4-(phenylmethyl)piperidin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 4-(4-benzyl-1-piperidyl)-8-bromo-5H-pyrimido[5,4-b]indole CAS Name: 8-bromo-4-[4-(phenylmethyl)-1-piperidinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 4-(4-benzylpiperidin-1-yl)-8-bromo-5H-pyrimido[5,4-b]indole Traditional Name: 4-(4-benzylpiperidino)-8-bromo-5H-pyrimid[5,4-b]indole Formula: C22H21BrN4 MolecularWeight: 421.33294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NC=NC4=C3NC5=C4C=C(C=C5)Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NC=NC4=C3NC5=C4C=C(C=C5)Br

InChI

InChI=1S/C22H21BrN4/c23-17-6-7-19-18(13-17)20-21(26-19)22(25-14-24-20)27-10-8-16(9-11-27)12-15-4-2-1-3-5-15/h1-7,13-14,16,26H,8-12H2