8-bromanyl-4-[(3S)-3-methylpiperazin-1-yl]-[1]benzofuro[3,2-d]pyrimidin-2-amine

Systemtic Name: 8-bromanyl-4-[(3S)-3-methylpiperazin-1-yl]-[1]benzofuro[3,2-d]pyrimidin-2-amine Openeye Name: 8-bromo-4-[(3S)-3-methylpiperazin-1-yl]benzofuro[3,2-d]pyrimidin-2-amine CAS Name: 8-bromo-4-[(3S)-3-methyl-1-piperazinyl]-2-benzofuro[3,2-d]pyrimidinamine IUPAC Name: 8-bromo-4-[(3S)-3-methylpiperazin-1-yl]-[1]benzofuro[3,2-d]pyrimidin-2-amine Traditional Name: [8-bromo-4-[(3S)-3-methylpiperazino]benzofuro[3,2-d]pyrimidin-2-yl]amine Formula: C15H16BrN5O MolecularWeight: 362.22444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=NC(=NC3=C2OC4=C3C=C(C=C4)Br)N

Isomeric SMILES

C[C@H]1CN(CCN1)C2=NC(=NC3=C2OC4=C3C=C(C=C4)Br)N

InChI

InChI=1S/C15H16BrN5O/c1-8-7-21(5-4-18-8)14-13-12(19-15(17)20-14)10-6-9(16)2-3-11(10)22-13/h2-3,6,8,18H,4-5,7H2,1H3,(H2,17,19,20)/t8-/m0/s1