3-[1-(2-bromanyl-4-propan-2-yl-phenyl)ethylamino]-5-chloranyl-1-pentan-3-yl-pyrazin-2-one

Systemtic Name: 3-[1-(2-bromanyl-4-propan-2-yl-phenyl)ethylamino]-5-chloranyl-1-pentan-3-yl-pyrazin-2-one Openeye Name: 3-[1-(2-bromo-4-isopropyl-phenyl)ethylamino]-5-chloro-1-(1-ethylpropyl)pyrazin-2-one CAS Name: 3-[1-(2-bromo-4-propan-2-ylphenyl)ethylamino]-5-chloro-1-pentan-3-yl-2-pyrazinone IUPAC Name: 3-[1-(2-bromo-4-propan-2-ylphenyl)ethylamino]-5-chloro-1-pentan-3-ylpyrazin-2-one Traditional Name: 3-[1-(2-bromo-4-isopropyl-phenyl)ethylamino]-5-chloro-1-(1-ethylpropyl)pyrazin-2-one Formula: C20H27BrClN3O MolecularWeight: 440.80488

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C=C(N=C(C1=O)NC(C)C2=C(C=C(C=C2)C(C)C)Br)Cl

Isomeric SMILES

CCC(CC)N1C=C(N=C(C1=O)NC(C)C2=C(C=C(C=C2)C(C)C)Br)Cl

InChI

InChI=1S/C20H27BrClN3O/c1-6-15(7-2)25-11-18(22)24-19(20(25)26)23-13(5)16-9-8-14(12(3)4)10-17(16)21/h8-13,15H,6-7H2,1-5H3,(H,23,24)