(Z)-3-(3-carbamimidoylphenyl)-2-fluoranyl-N-(4-propan-2-yloxyphenyl)but-2-enamide

Systemtic Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoranyl-N-(4-propan-2-yloxyphenyl)but-2-enamide Openeye Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoro-N-(4-isopropoxyphenyl)but-2-enamide CAS Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoro-N-(4-propan-2-yloxyphenyl)-2-butenamide IUPAC Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoro-N-(4-propan-2-yloxyphenyl)but-2-enamide Traditional Name: (Z)-3-(3-amidinophenyl)-2-fluoro-N-(4-isopropoxyphenyl)but-2-enamide Formula: C20H22FN3O2 MolecularWeight: 355.405983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)C(=C(C)C2=CC(=CC=C2)C(=N)N)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)/C(=C(\C)/C2=CC(=CC=C2)C(=N)N)/F

InChI

InChI=1S/C20H22FN3O2/c1-12(2)26-17-9-7-16(8-10-17)24-20(25)18(21)13(3)14-5-4-6-15(11-14)19(22)23/h4-12H,1-3H3,(H3,22,23)(H,24,25)/b18-13-