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

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(1,2,4-triazol-4-yl)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(1,2,4-triazol-4-yl)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-(1,2,4-triazol-4-yl)thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(1,2,4-triazol-4-yl)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(1,2,4-triazol-4-yl)thiourea Formula: C10H10ClN5S MolecularWeight: 267.7379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NN2C=NN=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)NN2C=NN=C2)Cl

InChI

InChI=1S/C10H10ClN5S/c11-9-3-1-8(2-4-9)5-12-10(17)15-16-6-13-14-7-16/h1-4,6-7H,5H2,(H2,12,15,17)