3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-(2,6-diethylphenyl)-1-(3-morpholinopropyl)-1-(o-tolylmethyl)thiourea CAS Name: 3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-(2,6-diethylphenyl)-1-(2-methylbenzyl)-1-(3-morpholinopropyl)thiourea Formula: C26H37N3OS MolecularWeight: 439.65648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3C

InChI

InChI=1S/C26H37N3OS/c1-4-22-12-8-13-23(5-2)25(22)27-26(31)29(20-24-11-7-6-10-21(24)3)15-9-14-28-16-18-30-19-17-28/h6-8,10-13H,4-5,9,14-20H2,1-3H3,(H,27,31)