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

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-propan-2-ylsulfonyl-ethanamide Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-2-(4-carbamimidoylanilino)-N-isopropylsulfonyl-acetamide CAS Name: 2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-N-propan-2-ylsulfonylacetamide IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-N-propan-2-ylsulfonylacetamide Traditional Name: 2-(4-amidinoanilino)-2-(4-benzoxy-3-methoxy-phenyl)-N-isopropylsulfonyl-acetamide Formula: C26H30N4O5S MolecularWeight: 510.6052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NC(=O)C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)S(=O)(=O)NC(=O)C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C26H30N4O5S/c1-17(2)36(32,33)30-26(31)24(29-21-12-9-19(10-13-21)25(27)28)20-11-14-22(23(15-20)34-3)35-16-18-7-5-4-6-8-18/h4-15,17,24,29H,16H2,1-3H3,(H3,27,28)(H,30,31)