2-[4-(2-azanyl-6-chloranyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(2-azanyl-6-chloranyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-(2-amino-6-chloro-pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-(2-amino-6-chloro-4-pyrimidinyl)-1,4-diazepan-1-yl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(2-amino-6-chloropyrimidin-4-yl)-1,4-diazepan-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-(2-amino-6-chloro-pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-isopropyl-acetamide Formula: C14H23ClN6O MolecularWeight: 326.82502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCCN(CC1)C2=CC(=NC(=N2)N)Cl

Isomeric SMILES

CC(C)NC(=O)CN1CCCN(CC1)C2=CC(=NC(=N2)N)Cl

InChI

InChI=1S/C14H23ClN6O/c1-10(2)17-13(22)9-20-4-3-5-21(7-6-20)12-8-11(15)18-14(16)19-12/h8,10H,3-7,9H2,1-2H3,(H,17,22)(H2,16,18,19)