1-(3,5-dimethylphenyl)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]thiourea Formula: C16H22N4S2 MolecularWeight: 334.50268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NCCSCC2=C(NC=N2)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NCCSCC2=C(NC=N2)C)C

InChI

InChI=1S/C16H22N4S2/c1-11-6-12(2)8-14(7-11)20-16(21)17-4-5-22-9-15-13(3)18-10-19-15/h6-8,10H,4-5,9H2,1-3H3,(H,18,19)(H2,17,20,21)