1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)-3-pentyl-thiourea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)-3-pentyl-thiourea Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholinoethyl)-3-pentyl-thiourea CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-[2-(4-morpholinyl)ethyl]-3-pentylthiourea IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)-3-pentylthiourea Traditional Name: 3-amyl-1-(2-morpholinoethyl)-1-veratryl-thiourea Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)N(CCN1CCOCC1)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCCNC(=S)N(CCN1CCOCC1)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H35N3O3S/c1-4-5-6-9-22-21(28)24(11-10-23-12-14-27-15-13-23)17-18-7-8-19(25-2)20(16-18)26-3/h7-8,16H,4-6,9-15,17H2,1-3H3,(H,22,28)