3-butan-2-yl-1-[(4-ethoxyphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-butan-2-yl-1-[(4-ethoxyphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[(4-ethoxyphenyl)methyl]-1-(3-morpholinopropyl)-3-sec-butyl-thiourea CAS Name: 3-butan-2-yl-1-[(4-ethoxyphenyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-butan-2-yl-1-[(4-ethoxyphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-(4-ethoxybenzyl)-1-(3-morpholinopropyl)-3-sec-butyl-thiourea Formula: C21H35N3O2S MolecularWeight: 393.5865

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N(CCCN1CCOCC1)CC2=CC=C(C=C2)OCC

Isomeric SMILES

CCC(C)NC(=S)N(CCCN1CCOCC1)CC2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H35N3O2S/c1-4-18(3)22-21(27)24(12-6-11-23-13-15-25-16-14-23)17-19-7-9-20(10-8-19)26-5-2/h7-10,18H,4-6,11-17H2,1-3H3,(H,22,27)