1-[(4-tert-butylphenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(3-morpholinopropyl)thiourea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-(4-tert-butylbenzyl)-3-(2-methoxy-4-methyl-phenyl)-1-(3-morpholinopropyl)thiourea Formula: C27H39N3O2S MolecularWeight: 469.68246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CCCN2CCOCC2)CC3=CC=C(C=C3)C(C)(C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CCCN2CCOCC2)CC3=CC=C(C=C3)C(C)(C)C)OC

InChI

InChI=1S/C27H39N3O2S/c1-21-7-12-24(25(19-21)31-5)28-26(33)30(14-6-13-29-15-17-32-18-16-29)20-22-8-10-23(11-9-22)27(2,3)4/h7-12,19H,6,13-18,20H2,1-5H3,(H,28,33)