3-azanyl-5-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethyl]-5-(cyclopropylamino)-6-oxidanylidene-pyrazin-2-yl]-N-propan-2-yl-benzamide

Systemtic Name: 3-azanyl-5-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethyl]-5-(cyclopropylamino)-6-oxidanylidene-pyrazin-2-yl]-N-propan-2-yl-benzamide Openeye Name: 3-amino-5-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxo-ethyl]-5-(cyclopropylamino)-6-oxo-pyrazin-2-yl]-N-isopropyl-benzamide CAS Name: 3-amino-5-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]-5-(cyclopropylamino)-6-oxo-2-pyrazinyl]-N-propan-2-ylbenzamide IUPAC Name: 3-amino-5-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]-5-(cyclopropylamino)-6-oxopyrazin-2-yl]-N-propan-2-ylbenzamide Traditional Name: 3-[1-[2-[(4-amidinobenzyl)amino]-2-keto-ethyl]-5-(cyclopropylamino)-6-keto-pyrazin-2-yl]-5-amino-N-isopropyl-benzamide Formula: C27H32N8O3 MolecularWeight: 516.59478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=CC(=C1)C2=CN=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NC4CC4)N

Isomeric SMILES

CC(C)NC(=O)C1=CC(=CC(=C1)C2=CN=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NC4CC4)N

InChI

InChI=1S/C27H32N8O3/c1-15(2)33-26(37)19-9-18(10-20(28)11-19)22-13-32-25(34-21-7-8-21)27(38)35(22)14-23(36)31-12-16-3-5-17(6-4-16)24(29)30/h3-6,9-11,13,15,21H,7-8,12,14,28H2,1-2H3,(H3,29,30)(H,31,36)(H,32,34)(H,33,37)