methyl (E)-2-phenyl-3-[5-[6-(N'-propan-2-ylcarbamimidoyl)-1H-benzimidazol-2-yl]furan-2-yl]prop-2-enoate

Systemtic Name: methyl (E)-2-phenyl-3-[5-[6-(N'-propan-2-ylcarbamimidoyl)-1H-benzimidazol-2-yl]furan-2-yl]prop-2-enoate Openeye Name: methyl (E)-3-[5-[6-(N'-isopropylcarbamimidoyl)-1H-benzimidazol-2-yl]-2-furyl]-2-phenyl-prop-2-enoate CAS Name: (E)-3-[5-[6-[amino(propan-2-ylimino)methyl]-1H-benzimidazol-2-yl]-2-furanyl]-2-phenyl-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-phenyl-3-[5-[6-(N'-propan-2-ylcarbamimidoyl)-1H-benzimidazol-2-yl]furan-2-yl]prop-2-enoate Traditional Name: (E)-3-[5-[6-(N'-isopropylamidino)-1H-benzimidazol-2-yl]-2-furyl]-2-phenyl-acrylic acid methyl ester Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(C1=CC2=C(C=C1)N=C(N2)C3=CC=C(O3)C=C(C4=CC=CC=C4)C(=O)OC)N

Isomeric SMILES

CC(C)N=C(C1=CC2=C(C=C1)N=C(N2)C3=CC=C(O3)/C=C(\C4=CC=CC=C4)/C(=O)OC)N

InChI

InChI=1S/C25H24N4O3/c1-15(2)27-23(26)17-9-11-20-21(13-17)29-24(28-20)22-12-10-18(32-22)14-19(25(30)31-3)16-7-5-4-6-8-16/h4-15H,1-3H3,(H2,26,27)(H,28,29)/b19-14+