1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclohexyl-thiourea

Systemtic Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclohexyl-thiourea Openeye Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclohexyl-thiourea CAS Name: 1-[3-[(4-chlorophenyl)methylthio]-1,2,4-triazol-4-yl]-3-cyclohexylthiourea IUPAC Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclohexylthiourea Traditional Name: 1-[3-[(4-chlorobenzyl)thio]-1,2,4-triazol-4-yl]-3-cyclohexyl-thiourea Formula: C16H20ClN5S2 MolecularWeight: 381.9465

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NN2C=NN=C2SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(CC1)NC(=S)NN2C=NN=C2SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H20ClN5S2/c17-13-8-6-12(7-9-13)10-24-16-20-18-11-22(16)21-15(23)19-14-4-2-1-3-5-14/h6-9,11,14H,1-5,10H2,(H2,19,21,23)