7-[1-butylsulfonyl-5-(1-ethanimidoylpiperidin-4-yl)oxy-2,3-dihydroindol-2-yl]naphthalene-2-carboximidamide dihydrochloride

Systemtic Name: 7-[1-butylsulfonyl-5-(1-ethanimidoylpiperidin-4-yl)oxy-2,3-dihydroindol-2-yl]naphthalene-2-carboximidamide dihydrochloride Openeye Name: 7-[1-butylsulfonyl-5-[(1-ethanimidoyl-4-piperidyl)oxy]indolin-2-yl]naphthalene-2-carboxamidine dihydrochloride CAS Name: 7-[1-butylsulfonyl-5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2,3-dihydroindol-2-yl]-2-naphthalenecarboximidamide dihydrochloride IUPAC Name: 7-[1-butylsulfonyl-5-(1-ethanimidoylpiperidin-4-yl)oxy-2,3-dihydroindol-2-yl]naphthalene-2-carboximidamide dihydrochloride Traditional Name: 7-[5-[(1-acetimidoyl-4-piperidyl)oxy]-1-butylsulfonyl-indolin-2-yl]-2-naphthamidine dihydrochloride Formula: C30H39Cl2N5O3S MolecularWeight: 620.63336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCN(CC3)C(=N)C)C4=CC5=C(C=C4)C=CC(=C5)C(=N)N.Cl.Cl

Isomeric SMILES

CCCCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCN(CC3)C(=N)C)C4=CC5=C(C=C4)C=CC(=C5)C(=N)N.Cl.Cl

InChI

InChI=1S/C30H37N5O3S.2ClH/c1-3-4-15-39(36,37)35-28-10-9-27(38-26-11-13-34(14-12-26)20(2)31)18-25(28)19-29(35)22-7-5-21-6-8-23(30(32)33)17-24(21)16-22;;/h5-10,16-18,26,29,31H,3-4,11-15,19H2,1-2H3,(H3,32,33);2*1H