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

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-ethylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-ethylphenyl)-1-(3-morpholinopropyl)thiourea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-ethylphenyl)-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3-(2-ethylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-(4-tert-butylbenzyl)-3-(2-ethylphenyl)-1-(3-morpholinopropyl)thiourea Formula: C27H39N3OS MolecularWeight: 453.68306

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CCCN2CCOCC2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CCCN2CCOCC2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H39N3OS/c1-5-23-9-6-7-10-25(23)28-26(32)30(16-8-15-29-17-19-31-20-18-29)21-22-11-13-24(14-12-22)27(2,3)4/h6-7,9-14H,5,8,15-21H2,1-4H3,(H,28,32)