methyl 3-[(N-phenyl-N'-prop-2-ynyl-carbamimidoyl)amino]pyrazine-2-carboxylate

Systemtic Name: methyl 3-[(N-phenyl-N'-prop-2-ynyl-carbamimidoyl)amino]pyrazine-2-carboxylate Openeye Name: methyl 3-[(N-phenyl-N'-prop-2-ynyl-carbamimidoyl)amino]pyrazine-2-carboxylate CAS Name: 3-[[anilino(prop-2-ynylimino)methyl]amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(N-phenyl-N'-prop-2-ynylcarbamimidoyl)amino]pyrazine-2-carboxylate Traditional Name: 3-[(N-phenyl-N'-propargyl-amidino)amino]pyrazinic acid methyl ester Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=CN=C1NC(=NCC#C)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NC=CN=C1NC(=NCC#C)NC2=CC=CC=C2

InChI

InChI=1S/C16H15N5O2/c1-3-9-19-16(20-12-7-5-4-6-8-12)21-14-13(15(22)23-2)17-10-11-18-14/h1,4-8,10-11H,9H2,2H3,(H2,18,19,20,21)