1-(4-butoxyphenyl)-3-(1-morpholin-4-yl-1-thiophen-2-yl-propan-2-yl)urea

Systemtic Name: 1-(4-butoxyphenyl)-3-(1-morpholin-4-yl-1-thiophen-2-yl-propan-2-yl)urea Openeye Name: 1-(4-butoxyphenyl)-3-[1-methyl-2-morpholino-2-(2-thienyl)ethyl]urea CAS Name: 1-(4-butoxyphenyl)-3-[1-(4-morpholinyl)-1-thiophen-2-ylpropan-2-yl]urea IUPAC Name: 1-(4-butoxyphenyl)-3-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)urea Traditional Name: 1-(4-butoxyphenyl)-3-[1-methyl-2-morpholino-2-(2-thienyl)ethyl]urea Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)NC(C)C(C2=CC=CS2)N3CCOCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)NC(C)C(C2=CC=CS2)N3CCOCC3

InChI

InChI=1S/C22H31N3O3S/c1-3-4-13-28-19-9-7-18(8-10-19)24-22(26)23-17(2)21(20-6-5-16-29-20)25-11-14-27-15-12-25/h5-10,16-17,21H,3-4,11-15H2,1-2H3,(H2,23,24,26)