1-(2,2-dimethyl-1-thiophen-2-yl-propyl)-3-[(6-morpholin-4-ylpyridin-3-yl)methyl]urea

Systemtic Name: 1-(2,2-dimethyl-1-thiophen-2-yl-propyl)-3-[(6-morpholin-4-ylpyridin-3-yl)methyl]urea Openeye Name: 1-[2,2-dimethyl-1-(2-thienyl)propyl]-3-[(6-morpholino-3-pyridyl)methyl]urea CAS Name: 1-(2,2-dimethyl-1-thiophen-2-ylpropyl)-3-[[6-(4-morpholinyl)-3-pyridinyl]methyl]urea IUPAC Name: 1-(2,2-dimethyl-1-thiophen-2-ylpropyl)-3-[(6-morpholin-4-ylpyridin-3-yl)methyl]urea Traditional Name: 1-[2,2-dimethyl-1-(2-thienyl)propyl]-3-[(6-morpholino-3-pyridyl)methyl]urea Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=CC=CS1)NC(=O)NCC2=CN=C(C=C2)N3CCOCC3

Isomeric SMILES

CC(C)(C)C(C1=CC=CS1)NC(=O)NCC2=CN=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H28N4O2S/c1-20(2,3)18(16-5-4-12-27-16)23-19(25)22-14-15-6-7-17(21-13-15)24-8-10-26-11-9-24/h4-7,12-13,18H,8-11,14H2,1-3H3,(H2,22,23,25)