N-[5-(2-azanylethylcarbamoyl)-2-[(4-ethanoylpiperazin-1-yl)methyl]phenyl]morpholine-4-carboxamide

Systemtic Name: N-[5-(2-azanylethylcarbamoyl)-2-[(4-ethanoylpiperazin-1-yl)methyl]phenyl]morpholine-4-carboxamide Openeye Name: N-[2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-aminoethylcarbamoyl)phenyl]morpholine-4-carboxamide CAS Name: N-[2-[(4-acetyl-1-piperazinyl)methyl]-5-[(2-aminoethylamino)-oxomethyl]phenyl]-4-morpholinecarboxamide IUPAC Name: N-[2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-aminoethylcarbamoyl)phenyl]morpholine-4-carboxamide Traditional Name: N-[2-[(4-acetylpiperazino)methyl]-5-(2-aminoethylcarbamoyl)phenyl]morpholine-4-carboxamide Formula: C21H32N6O4 MolecularWeight: 432.51658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)NCCN)NC(=O)N3CCOCC3

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)NCCN)NC(=O)N3CCOCC3

InChI

InChI=1S/C21H32N6O4/c1-16(28)26-8-6-25(7-9-26)15-18-3-2-17(20(29)23-5-4-22)14-19(18)24-21(30)27-10-12-31-13-11-27/h2-3,14H,4-13,15,22H2,1H3,(H,23,29)(H,24,30)