N-[1-[[3-(4H-imidazol-4-yl)-1-(6-oxidanylhexylamino)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-piperazine-1-carboxamide

Systemtic Name: N-[1-[[3-(4H-imidazol-4-yl)-1-(6-oxidanylhexylamino)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-piperazine-1-carboxamide Openeye Name: N-[1-benzyl-2-[[2-(6-hydroxyhexylamino)-1-(4H-imidazol-4-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]-4-methyl-piperazine-1-carboxamide CAS Name: N-[1-[[1-(6-hydroxyhexylamino)-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methyl-1-piperazinecarboxamide IUPAC Name: N-[1-[[1-(6-hydroxyhexylamino)-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methylpiperazine-1-carboxamide Traditional Name: N-[1-benzyl-2-[[2-(6-hydroxyhexylamino)-1-(4H-imidazol-4-ylmethyl)-2-keto-ethyl]amino]-2-keto-ethyl]-4-methyl-piperazine-1-carboxamide Formula: C27H41N7O4 MolecularWeight: 527.65894

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3C=NC=N3)C(=O)NCCCCCCO

Isomeric SMILES

CN1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3C=NC=N3)C(=O)NCCCCCCO

InChI

InChI=1S/C27H41N7O4/c1-33-12-14-34(15-13-33)27(38)32-23(17-21-9-5-4-6-10-21)26(37)31-24(18-22-19-28-20-30-22)25(36)29-11-7-2-3-8-16-35/h4-6,9-10,19-20,22-24,35H,2-3,7-8,11-18H2,1H3,(H,29,36)(H,31,37)(H,32,38)