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

Systemtic Name: 7-[5-(1-ethanimidoylpiperidin-4-yl)oxy-1-(phenylsulfonyl)-2,3-dihydroindol-2-yl]naphthalene-2-carboximidamide dihydrochloride Openeye Name: 7-[1-(benzenesulfonyl)-5-[(1-ethanimidoyl-4-piperidyl)oxy]indolin-2-yl]naphthalene-2-carboxamidine dihydrochloride CAS Name: 7-[1-(benzenesulfonyl)-5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2,3-dihydroindol-2-yl]-2-naphthalenecarboximidamide dihydrochloride IUPAC Name: 7-[1-(benzenesulfonyl)-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-besyl-indolin-2-yl]-2-naphthamidine dihydrochloride Formula: C32H35Cl2N5O3S MolecularWeight: 640.623

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(C3)C4=CC5=C(C=C4)C=CC(=C5)C(=N)N)S(=O)(=O)C6=CC=CC=C6.Cl.Cl

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(C3)C4=CC5=C(C=C4)C=CC(=C5)C(=N)N)S(=O)(=O)C6=CC=CC=C6.Cl.Cl

InChI

InChI=1S/C32H33N5O3S.2ClH/c1-21(33)36-15-13-27(14-16-36)40-28-11-12-30-26(19-28)20-31(37(30)41(38,39)29-5-3-2-4-6-29)23-9-7-22-8-10-24(32(34)35)18-25(22)17-23;;/h2-12,17-19,27,31,33H,13-16,20H2,1H3,(H3,34,35);2*1H