3-(3-ethylphenyl)-1-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-(3-ethylphenyl)-1-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-(3-ethylphenyl)-1-[1-(7-methoxybenzofuran-2-yl)ethyl]-1-(3-morpholinopropyl)thiourea CAS Name: 3-(3-ethylphenyl)-1-[1-(7-methoxy-2-benzofuranyl)ethyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-(3-ethylphenyl)-1-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-(3-ethylphenyl)-1-[1-(7-methoxybenzofuran-2-yl)ethyl]-1-(3-morpholinopropyl)thiourea Formula: C27H35N3O3S MolecularWeight: 481.6501

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N(CCCN2CCOCC2)C(C)C3=CC4=C(O3)C(=CC=C4)OC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N(CCCN2CCOCC2)C(C)C3=CC4=C(O3)C(=CC=C4)OC

InChI

InChI=1S/C27H35N3O3S/c1-4-21-8-5-10-23(18-21)28-27(34)30(13-7-12-29-14-16-32-17-15-29)20(2)25-19-22-9-6-11-24(31-3)26(22)33-25/h5-6,8-11,18-20H,4,7,12-17H2,1-3H3,(H,28,34)