3-[4-(4-methylpiperazin-1-yl)carbonylphenoxy]-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylpropan-2-yl]oxy-benzamide

Systemtic Name: 3-[4-(4-methylpiperazin-1-yl)carbonylphenoxy]-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylpropan-2-yl]oxy-benzamide Openeye Name: 3-[(1S)-2-hydroxy-1-methyl-ethoxy]-5-[4-(4-methylpiperazine-1-carbonyl)phenoxy]-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 3-[(2S)-1-hydroxypropan-2-yl]oxy-5-[4-[(4-methyl-1-piperazinyl)-oxomethyl]phenoxy]-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-[(2S)-1-hydroxypropan-2-yl]oxy-5-[4-(4-methylpiperazine-1-carbonyl)phenoxy]-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 3-[(1S)-2-hydroxy-1-methyl-ethoxy]-5-[4-(4-methylpiperazine-1-carbonyl)phenoxy]-N-(1-methylpyrazol-3-yl)benzamide Formula: C26H31N5O5 MolecularWeight: 493.55484

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)C(=O)N3CCN(CC3)C)C(=O)NC4=NN(C=C4)C

Isomeric SMILES

C[C@@H](CO)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)C(=O)N3CCN(CC3)C)C(=O)NC4=NN(C=C4)C

InChI

InChI=1S/C26H31N5O5/c1-18(17-32)35-22-14-20(25(33)27-24-8-9-30(3)28-24)15-23(16-22)36-21-6-4-19(5-7-21)26(34)31-12-10-29(2)11-13-31/h4-9,14-16,18,32H,10-13,17H2,1-3H3,(H,27,28,33)/t18-/m0/s1