N-[1-[[3-(4H-imidazol-4-yl)-1-(6-oxidanylhexylamino)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]piperidine-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]piperidine-1-carboxamide Openeye Name: N-[1-benzyl-2-[[2-(6-hydroxyhexylamino)-1-(4H-imidazol-4-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]piperidine-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]-1-piperidinecarboxamide IUPAC Name: N-[1-[[1-(6-hydroxyhexylamino)-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]piperidine-1-carboxamide Traditional Name: N-[1-benzyl-2-[[2-(6-hydroxyhexylamino)-1-(4H-imidazol-4-ylmethyl)-2-keto-ethyl]amino]-2-keto-ethyl]piperidine-1-carboxamide Formula: C27H40N6O4 MolecularWeight: 512.6443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3C=NC=N3)C(=O)NCCCCCCO

Isomeric SMILES

C1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3C=NC=N3)C(=O)NCCCCCCO

InChI

InChI=1S/C27H40N6O4/c34-16-10-2-1-7-13-29-25(35)24(18-22-19-28-20-30-22)31-26(36)23(17-21-11-5-3-6-12-21)32-27(37)33-14-8-4-9-15-33/h3,5-6,11-12,19-20,22-24,34H,1-2,4,7-10,13-18H2,(H,29,35)(H,31,36)(H,32,37)