3-(3-chloranyl-2-methyl-phenyl)-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea Openeye Name: 3-(3-chloro-2-methyl-phenyl)-1-(3-imidazol-1-ylpropyl)-1-(p-tolylmethyl)thiourea CAS Name: 3-(3-chloro-2-methylphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(4-methylphenyl)methyl]thiourea IUPAC Name: 3-(3-chloro-2-methylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea Traditional Name: 3-(3-chloro-2-methyl-phenyl)-1-(3-imidazol-1-ylpropyl)-1-(4-methylbenzyl)thiourea Formula: C22H25ClN4S MolecularWeight: 412.9787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C22H25ClN4S/c1-17-7-9-19(10-8-17)15-27(13-4-12-26-14-11-24-16-26)22(28)25-21-6-3-5-20(23)18(21)2/h3,5-11,14,16H,4,12-13,15H2,1-2H3,(H,25,28)