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

Systemtic Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclopropyl-thiourea Openeye Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclopropyl-thiourea CAS Name: 1-[3-[(4-chlorophenyl)methylthio]-1,2,4-triazol-4-yl]-3-cyclopropylthiourea IUPAC Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-3-cyclopropylthiourea Traditional Name: 1-[3-[(4-chlorobenzyl)thio]-1,2,4-triazol-4-yl]-3-cyclopropyl-thiourea Formula: C13H14ClN5S2 MolecularWeight: 339.86676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)NN2C=NN=C2SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1NC(=S)NN2C=NN=C2SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C13H14ClN5S2/c14-10-3-1-9(2-4-10)7-21-13-17-15-8-19(13)18-12(20)16-11-5-6-11/h1-4,8,11H,5-7H2,(H2,16,18,20)