N-[1-[[1-(6-oxidanylhexylamino)-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]thiomorpholine-4-carboxamide

Systemtic Name: N-[1-[[1-(6-oxidanylhexylamino)-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]thiomorpholine-4-carboxamide Openeye Name: N-[1-benzyl-2-[1-(6-hydroxyhexylcarbamoyl)butylamino]-2-oxo-ethyl]thiomorpholine-4-carboxamide CAS Name: N-[1-[[1-(6-hydroxyhexylamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-thiomorpholinecarboxamide IUPAC Name: N-[1-[[1-(6-hydroxyhexylamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]thiomorpholine-4-carboxamide Traditional Name: N-[1-benzyl-2-[1-(6-hydroxyhexylcarbamoyl)butylamino]-2-keto-ethyl]thiomorpholine-4-carboxamide Formula: C25H40N4O4S MolecularWeight: 492.6745

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCCCCCCO)NC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCSCC2

Isomeric SMILES

CCCC(C(=O)NCCCCCCO)NC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCSCC2

InChI

InChI=1S/C25H40N4O4S/c1-2-10-21(23(31)26-13-8-3-4-9-16-30)27-24(32)22(19-20-11-6-5-7-12-20)28-25(33)29-14-17-34-18-15-29/h5-7,11-12,21-22,30H,2-4,8-10,13-19H2,1H3,(H,26,31)(H,27,32)(H,28,33)