2-[6-(2-aminophenyl)-3-(cyclobutylamino)-2-oxidanylidene-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide

Systemtic Name: 2-[6-(2-aminophenyl)-3-(cyclobutylamino)-2-oxidanylidene-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]ethanamide Openeye Name: 2-[6-(2-aminophenyl)-3-(cyclobutylamino)-2-oxo-pyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[6-(2-aminophenyl)-3-(cyclobutylamino)-2-oxo-1-pyrazinyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[6-(2-aminophenyl)-3-(cyclobutylamino)-2-oxopyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[6-(2-aminophenyl)-3-(cyclobutylamino)-2-keto-pyrazin-1-yl]acetamide Formula: C24H27N7O2 MolecularWeight: 445.51688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC2=NC=C(N(C2=O)CC(=O)NCC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4N

Isomeric SMILES

C1CC(C1)NC2=NC=C(N(C2=O)CC(=O)NCC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4N

InChI

InChI=1S/C24H27N7O2/c25-19-7-2-1-6-18(19)20-13-29-23(30-17-4-3-5-17)24(33)31(20)14-21(32)28-12-15-8-10-16(11-9-15)22(26)27/h1-2,6-11,13,17H,3-5,12,14,25H2,(H3,26,27)(H,28,32)(H,29,30)