2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-thiophen-2-ylsulfonyl-ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-thiophen-2-ylsulfonyl-ethanamide Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-2-(4-carbamimidoylanilino)-N-(2-thienylsulfonyl)acetamide CAS Name: 2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-N-thiophen-2-ylsulfonylacetamide IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-N-thiophen-2-ylsulfonylacetamide Traditional Name: 2-(4-amidinoanilino)-2-(4-benzoxy-3-methoxy-phenyl)-N-(2-thienylsulfonyl)acetamide Formula: C27H26N4O5S2 MolecularWeight: 550.64914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C2=CC=CS2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C2=CC=CS2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O5S2/c1-35-23-16-20(11-14-22(23)36-17-18-6-3-2-4-7-18)25(30-21-12-9-19(10-13-21)26(28)29)27(32)31-38(33,34)24-8-5-15-37-24/h2-16,25,30H,17H2,1H3,(H3,28,29)(H,31,32)