ethyl 2-[4-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]-2-oxidanylidene-piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]-2-oxidanylidene-piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[3-(4-carbamimidoylanilino)-3-oxo-propyl]-2-oxo-piperazin-1-yl]acetate CAS Name: 2-[4-[3-(4-carbamimidoylanilino)-3-oxopropyl]-2-oxo-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-(4-carbamimidoylanilino)-3-oxopropyl]-2-oxopiperazin-1-yl]acetate Traditional Name: 2-[4-[3-(4-amidinoanilino)-3-keto-propyl]-2-keto-piperazino]acetic acid ethyl ester Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1=O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CN1CCN(CC1=O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H25N5O4/c1-2-27-17(26)12-23-10-9-22(11-16(23)25)8-7-15(24)21-14-5-3-13(4-6-14)18(19)20/h3-6H,2,7-12H2,1H3,(H3,19,20)(H,21,24)