N-[(5-carbamimidoylthiophen-2-yl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-[(5-carbamimidoylthiophen-2-yl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-[(5-carbamimidoyl-2-thienyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxo-1-pyridyl]acetamide CAS Name: N-[(5-carbamimidoyl-2-thiophenyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide IUPAC Name: N-[(5-carbamimidoylthiophen-2-yl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxopyridin-1-yl]acetamide Traditional Name: N-[(5-amidino-2-thienyl)methyl]-2-[2-keto-3-[(3-methoxyphenyl)sulfonylamino]-1-pyridyl]acetamide Formula: C20H21N5O5S2 MolecularWeight: 475.54124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CN(C2=O)CC(=O)NCC3=CC=C(S3)C(=N)N

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CN(C2=O)CC(=O)NCC3=CC=C(S3)C(=N)N

InChI

InChI=1S/C20H21N5O5S2/c1-30-13-4-2-5-15(10-13)32(28,29)24-16-6-3-9-25(20(16)27)12-18(26)23-11-14-7-8-17(31-14)19(21)22/h2-10,24H,11-12H2,1H3,(H3,21,22)(H,23,26)