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

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-3-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(3-imidazol-1-ylpropyl)-3-(p-tolylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[3-(1-imidazolyl)propyl]-3-[(4-methylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-3-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-3-(4-methylbenzyl)-1-(3-pyridylmethyl)thiourea Formula: C21H25N5S MolecularWeight: 379.5217

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)N(CCCN2C=CN=C2)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)N(CCCN2C=CN=C2)CC3=CN=CC=C3

InChI

InChI=1S/C21H25N5S/c1-18-5-7-19(8-6-18)15-24-21(27)26(16-20-4-2-9-22-14-20)12-3-11-25-13-10-23-17-25/h2,4-10,13-14,17H,3,11-12,15-16H2,1H3,(H,24,27)