3-dodecyl-1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-dodecyl-1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 3-dodecyl-1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 3-dodecyl-1-[3-(1-imidazolyl)propyl]-1-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 3-dodecyl-1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-3-lauryl-1-p-anisyl-thiourea Formula: C27H44N4OS MolecularWeight: 472.72946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)N(CCCN1C=CN=C1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCCCCCCNC(=S)N(CCCN1C=CN=C1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C27H44N4OS/c1-3-4-5-6-7-8-9-10-11-12-18-29-27(33)31(21-13-20-30-22-19-28-24-30)23-25-14-16-26(32-2)17-15-25/h14-17,19,22,24H,3-13,18,20-21,23H2,1-2H3,(H,29,33)