N-[(3-carbamimidoylphenyl)methyl]-2-[6-oxidanylidene-2-phenyl-5-[(phenylmethyl)sulfonylamino]pyrimidin-1-yl]ethanamide

Systemtic Name: N-[(3-carbamimidoylphenyl)methyl]-2-[6-oxidanylidene-2-phenyl-5-[(phenylmethyl)sulfonylamino]pyrimidin-1-yl]ethanamide Openeye Name: 2-[5-(benzylsulfonylamino)-6-oxo-2-phenyl-pyrimidin-1-yl]-N-[(3-carbamimidoylphenyl)methyl]acetamide CAS Name: N-[(3-carbamimidoylphenyl)methyl]-2-[6-oxo-2-phenyl-5-[(phenylmethyl)sulfonylamino]-1-pyrimidinyl]acetamide IUPAC Name: 2-[5-(benzylsulfonylamino)-6-oxo-2-phenylpyrimidin-1-yl]-N-[(3-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(3-amidinobenzyl)-2-[5-(benzylsulfonylamino)-6-keto-2-phenyl-pyrimidin-1-yl]acetamide Formula: C27H26N6O4S MolecularWeight: 530.59814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC2=CN=C(N(C2=O)CC(=O)NCC3=CC=CC(=C3)C(=N)N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NC2=CN=C(N(C2=O)CC(=O)NCC3=CC=CC(=C3)C(=N)N)C4=CC=CC=C4

InChI

InChI=1S/C27H26N6O4S/c28-25(29)22-13-7-10-20(14-22)15-30-24(34)17-33-26(21-11-5-2-6-12-21)31-16-23(27(33)35)32-38(36,37)18-19-8-3-1-4-9-19/h1-14,16,32H,15,17-18H2,(H3,28,29)(H,30,34)