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

Systemtic Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-octyl-thiourea Openeye Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-octyl-thiourea CAS Name: 1-[(4-dimethylaminophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-octylthiourea IUPAC Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-octylthiourea Traditional Name: 1-[4-(dimethylamino)benzyl]-1-(3-imidazol-1-ylpropyl)-3-octyl-thiourea Formula: C24H39N5S MolecularWeight: 429.66496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H39N5S/c1-4-5-6-7-8-9-15-26-24(30)29(18-10-17-28-19-16-25-21-28)20-22-11-13-23(14-12-22)27(2)3/h11-14,16,19,21H,4-10,15,17-18,20H2,1-3H3,(H,26,30)