3-hexyl-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-hexyl-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-hexyl-1-(3-morpholinopropyl)-1-(o-tolylmethyl)thiourea CAS Name: 3-hexyl-1-[(2-methylphenyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-hexyl-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-hexyl-1-(2-methylbenzyl)-1-(3-morpholinopropyl)thiourea Formula: C22H37N3OS MolecularWeight: 391.61368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)N(CCCN1CCOCC1)CC2=CC=CC=C2C

Isomeric SMILES

CCCCCCNC(=S)N(CCCN1CCOCC1)CC2=CC=CC=C2C

InChI

InChI=1S/C22H37N3OS/c1-3-4-5-8-12-23-22(27)25(19-21-11-7-6-10-20(21)2)14-9-13-24-15-17-26-18-16-24/h6-7,10-11H,3-5,8-9,12-19H2,1-2H3,(H,23,27)