1-[1-(1-benzofuran-2-yl)ethyl]-3-(3-methylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 1-[1-(1-benzofuran-2-yl)ethyl]-3-(3-methylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[1-(benzofuran-2-yl)ethyl]-1-(3-morpholinopropyl)-3-(m-tolyl)thiourea CAS Name: 1-[1-(2-benzofuranyl)ethyl]-3-(3-methylphenyl)-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[1-(1-benzofuran-2-yl)ethyl]-3-(3-methylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-[1-(benzofuran-2-yl)ethyl]-1-(3-morpholinopropyl)-3-(m-tolyl)thiourea Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CCCN2CCOCC2)C(C)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCCN2CCOCC2)C(C)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C25H31N3O2S/c1-19-7-5-9-22(17-19)26-25(31)28(12-6-11-27-13-15-29-16-14-27)20(2)24-18-21-8-3-4-10-23(21)30-24/h3-5,7-10,17-18,20H,6,11-16H2,1-2H3,(H,26,31)