1-[(4-chlorophenyl)methoxy]-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol

Systemtic Name: 1-[(4-chlorophenyl)methoxy]-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol Openeye Name: 1-[(4-chlorophenyl)methoxy]-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol CAS Name: 1-[(4-chlorophenyl)methoxy]-3-(1H-1,2,4-triazol-5-ylthio)-2-propanol IUPAC Name: 1-[(4-chlorophenyl)methoxy]-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol Traditional Name: 1-(4-chlorobenzyl)oxy-3-(1H-1,2,4-triazol-5-ylthio)propan-2-ol Formula: C12H14ClN3O2S MolecularWeight: 299.77646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COCC(CSC2=NC=NN2)O)Cl

Isomeric SMILES

C1=CC(=CC=C1COCC(CSC2=NC=NN2)O)Cl

InChI

InChI=1S/C12H14ClN3O2S/c13-10-3-1-9(2-4-10)5-18-6-11(17)7-19-12-14-8-15-16-12/h1-4,8,11,17H,5-7H2,(H,14,15,16)