N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloranyl-2-oxidanylidene-3-(3-oxidanylpropylamino)-6-phenyl-pyrazin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloranyl-2-oxidanylidene-3-(3-oxidanylpropylamino)-6-phenyl-pyrazin-1-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(3-hydroxypropylamino)-2-oxo-6-phenyl-pyrazin-1-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(3-hydroxypropylamino)-2-oxo-6-phenyl-1-pyrazinyl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(3-hydroxypropylamino)-2-oxo-6-phenylpyrazin-1-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[5-chloro-3-(3-hydroxypropylamino)-2-keto-6-phenyl-pyrazin-1-yl]acetamide Formula: C23H25ClN6O3 MolecularWeight: 468.936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NCCCO)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NCCCO)Cl

InChI

InChI=1S/C23H25ClN6O3/c24-20-19(16-5-2-1-3-6-16)30(23(33)22(29-20)27-11-4-12-31)14-18(32)28-13-15-7-9-17(10-8-15)21(25)26/h1-3,5-10,31H,4,11-14H2,(H3,25,26)(H,27,29)(H,28,32)