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

Systemtic Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea Openeye Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-(p-tolylmethyl)thiourea CAS Name: 3-heptyl-1-[3-(1-imidazolyl)propyl]-1-[(4-methylphenyl)methyl]thiourea IUPAC Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea Traditional Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-(4-methylbenzyl)thiourea Formula: C22H34N4S MolecularWeight: 386.59716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34N4S/c1-3-4-5-6-7-13-24-22(27)26(16-8-15-25-17-14-23-19-25)18-21-11-9-20(2)10-12-21/h9-12,14,17,19H,3-8,13,15-16,18H2,1-2H3,(H,24,27)