N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]-2-(3-piperidin-1-ylpropoxy)benzamide dihydrochloride

Systemtic Name: N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]-2-(3-piperidin-1-ylpropoxy)benzamide dihydrochloride Openeye Name: N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]carbamoyl]phenyl]-2-[3-(1-piperidyl)propoxy]benzamide dihydrochloride CAS Name: N-[4-[[N-methyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]anilino]-oxomethyl]phenyl]-2-[3-(1-piperidinyl)propoxy]benzamide dihydrochloride IUPAC Name: N-[4-[methyl-[2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]carbamoyl]phenyl]-2-(3-piperidin-1-ylpropoxy)benzamide dihydrochloride Traditional Name: N-[4-[[2-[6-keto-6-(4-methylpiperazino)hexoxy]phenyl]-methyl-carbamoyl]phenyl]-2-(3-piperidinopropoxy)benzamide dihydrochloride Formula: C40H55Cl2N5O5 MolecularWeight: 756.8012

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCCCOC2=CC=CC=C2N(C)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4OCCCN5CCCCC5.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCCCOC2=CC=CC=C2N(C)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4OCCCN5CCCCC5.Cl.Cl

InChI

InChI=1S/C40H53N5O5.2ClH/c1-42-26-28-45(29-27-42)38(46)18-5-3-12-30-50-37-17-9-7-15-35(37)43(2)40(48)32-19-21-33(22-20-32)41-39(47)34-14-6-8-16-36(34)49-31-13-25-44-23-10-4-11-24-44;;/h6-9,14-17,19-22H,3-5,10-13,18,23-31H2,1-2H3,(H,41,47);2*1H