8-chloranyl-4-(4-methyl-1,4-diazepan-1-yl)-[1]benzofuro[3,2-d]pyrimidin-2-amine

Systemtic Name: 8-chloranyl-4-(4-methyl-1,4-diazepan-1-yl)-[1]benzofuro[3,2-d]pyrimidin-2-amine Openeye Name: 8-chloro-4-(4-methyl-1,4-diazepan-1-yl)benzofuro[3,2-d]pyrimidin-2-amine CAS Name: 8-chloro-4-(4-methyl-1,4-diazepan-1-yl)-2-benzofuro[3,2-d]pyrimidinamine IUPAC Name: 8-chloro-4-(4-methyl-1,4-diazepan-1-yl)-[1]benzofuro[3,2-d]pyrimidin-2-amine Traditional Name: [8-chloro-4-(4-methyl-1,4-diazepan-1-yl)benzofuro[3,2-d]pyrimidin-2-yl]amine Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC(=NC3=C2OC4=C3C=C(C=C4)Cl)N

Isomeric SMILES

CN1CCCN(CC1)C2=NC(=NC3=C2OC4=C3C=C(C=C4)Cl)N

InChI

InChI=1S/C16H18ClN5O/c1-21-5-2-6-22(8-7-21)15-14-13(19-16(18)20-15)11-9-10(17)3-4-12(11)23-14/h3-4,9H,2,5-8H2,1H3,(H2,18,19,20)