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

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]-3-methyl-thiourea Openeye Name: 1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]-3-methyl-thiourea CAS Name: 1-[3-(1-imidazolyl)propyl]-1-[(4-methoxyphenyl)methyl]-3-methylthiourea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-1-[(4-methoxyphenyl)methyl]-3-methylthiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-3-methyl-1-p-anisyl-thiourea Formula: C16H22N4OS MolecularWeight: 318.43708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4OS/c1-17-16(22)20(10-3-9-19-11-8-18-13-19)12-14-4-6-15(21-2)7-5-14/h4-8,11,13H,3,9-10,12H2,1-2H3,(H,17,22)