3-(but-3-ynylamino)-5-chloranyl-6-methyl-1-(phenylmethyl)pyrazin-2-one

Systemtic Name: 3-(but-3-ynylamino)-5-chloranyl-6-methyl-1-(phenylmethyl)pyrazin-2-one Openeye Name: 1-benzyl-3-(but-3-ynylamino)-5-chloro-6-methyl-pyrazin-2-one CAS Name: 3-(but-3-ynylamino)-5-chloro-6-methyl-1-(phenylmethyl)-2-pyrazinone IUPAC Name: 1-benzyl-3-(but-3-ynylamino)-5-chloro-6-methylpyrazin-2-one Traditional Name: 1-benzyl-3-(but-3-ynylamino)-5-chloro-6-methyl-pyrazin-2-one Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=O)N1CC2=CC=CC=C2)NCCC#C)Cl

Isomeric SMILES

CC1=C(N=C(C(=O)N1CC2=CC=CC=C2)NCCC#C)Cl

InChI

InChI=1S/C16H16ClN3O/c1-3-4-10-18-15-16(21)20(12(2)14(17)19-15)11-13-8-6-5-7-9-13/h1,5-9H,4,10-11H2,2H3,(H,18,19)