methyl 2-[1-[5-(4-carbamimidoylphenyl)pyrazin-2-yl]carbonylpiperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[1-[5-(4-carbamimidoylphenyl)pyrazin-2-yl]carbonylpiperidin-4-yl]ethanoate Openeye Name: methyl 2-[1-[5-(4-carbamimidoylphenyl)pyrazine-2-carbonyl]-4-piperidyl]acetate CAS Name: 2-[1-[[5-(4-carbamimidoylphenyl)-2-pyrazinyl]-oxomethyl]-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[5-(4-carbamimidoylphenyl)pyrazine-2-carbonyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[5-(4-amidinophenyl)pyrazinoyl]-4-piperidyl]acetic acid methyl ester Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCN(CC1)C(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CC1CCN(CC1)C(=O)C2=NC=C(N=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H23N5O3/c1-28-18(26)10-13-6-8-25(9-7-13)20(27)17-12-23-16(11-24-17)14-2-4-15(5-3-14)19(21)22/h2-5,11-13H,6-10H2,1H3,(H3,21,22)