(2S,4R)-4-(3-carbamimidoylphenoxy)-N-(4-carbamimidoylphenyl)-1-propan-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-(3-carbamimidoylphenoxy)-N-(4-carbamimidoylphenyl)-1-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-4-(3-carbamimidoylphenoxy)-N-(4-carbamimidoylphenyl)-1-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-(3-carbamimidoylphenoxy)-N-(4-carbamimidoylphenyl)-1-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-4-(3-carbamimidoylphenoxy)-N-(4-carbamimidoylphenyl)-1-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-4-(3-amidinophenoxy)-N-(4-amidinophenyl)-1-isopropyl-pyrrolidine-2-carboxamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1C(=O)NC2=CC=C(C=C2)C(=N)N)OC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(C)N1C[C@@H](C[C@H]1C(=O)NC2=CC=C(C=C2)C(=N)N)OC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H28N6O2/c1-13(2)28-12-18(30-17-5-3-4-15(10-17)21(25)26)11-19(28)22(29)27-16-8-6-14(7-9-16)20(23)24/h3-10,13,18-19H,11-12H2,1-2H3,(H3,23,24)(H3,25,26)(H,27,29)/t18-,19+/m1/s1