3-[(E)-2-[5-(1-ethanimidoylpiperidin-4-yl)oxy-1-ethylsulfonyl-2,3-dihydroindol-2-yl]ethenyl]benzenecarboximidamide

Systemtic Name: 3-[(E)-2-[5-(1-ethanimidoylpiperidin-4-yl)oxy-1-ethylsulfonyl-2,3-dihydroindol-2-yl]ethenyl]benzenecarboximidamide Openeye Name: 3-[(E)-2-[5-[(1-ethanimidoyl-4-piperidyl)oxy]-1-ethylsulfonyl-indolin-2-yl]vinyl]benzamidine CAS Name: 3-[(E)-2-[1-ethylsulfonyl-5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2,3-dihydroindol-2-yl]ethenyl]benzenecarboximidamide IUPAC Name: 3-[(E)-2-[5-(1-ethanimidoylpiperidin-4-yl)oxy-1-ethylsulfonyl-2,3-dihydroindol-2-yl]ethenyl]benzenecarboximidamide Traditional Name: 3-[(E)-2-[5-[(1-acetimidoyl-4-piperidyl)oxy]-1-esyl-indolin-2-yl]vinyl]benzamidine Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCN(CC3)C(=N)C)C=CC4=CC(=CC=C4)C(=N)N

Isomeric SMILES

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCN(CC3)C(=N)C)/C=C/C4=CC(=CC=C4)C(=N)N

InChI

InChI=1S/C26H33N5O3S/c1-3-35(32,33)31-22(8-7-19-5-4-6-20(15-19)26(28)29)16-21-17-24(9-10-25(21)31)34-23-11-13-30(14-12-23)18(2)27/h4-10,15,17,22-23,27H,3,11-14,16H2,1-2H3,(H3,28,29)/b8-7+,27-18?