1-(4-heptoxyphenyl)-3-[(2S)-1-(4-morpholin-4-ylcarbonylpiperidin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]urea

Systemtic Name: 1-(4-heptoxyphenyl)-3-[(2S)-1-(4-morpholin-4-ylcarbonylpiperidin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]urea Openeye Name: 1-[(1S)-1-benzyl-2-[4-(morpholine-4-carbonyl)-1-piperidyl]-2-oxo-ethyl]-3-(4-heptoxyphenyl)urea CAS Name: 1-(4-heptoxyphenyl)-3-[(2S)-1-[4-[4-morpholinyl(oxo)methyl]-1-piperidinyl]-1-oxo-3-phenylpropan-2-yl]urea IUPAC Name: 1-(4-heptoxyphenyl)-3-[(2S)-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]urea Traditional Name: 1-[(1S)-1-benzyl-2-keto-2-[4-(morpholine-4-carbonyl)piperidino]ethyl]-3-(4-heptoxyphenyl)urea Formula: C33H46N4O5 MolecularWeight: 578.74214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC(CC3)C(=O)N4CCOCC4

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N3CCC(CC3)C(=O)N4CCOCC4

InChI

InChI=1S/C33H46N4O5/c1-2-3-4-5-9-22-42-29-14-12-28(13-15-29)34-33(40)35-30(25-26-10-7-6-8-11-26)32(39)36-18-16-27(17-19-36)31(38)37-20-23-41-24-21-37/h6-8,10-15,27,30H,2-5,9,16-25H2,1H3,(H2,34,35,40)/t30-/m0/s1