chloranylbenzene; 2-(2-chloranylphenoxy)-1-cyclopropyl-1-sulfanyl-3-(1,2,4-triazol-1-yl)propan-2-ol

Systemtic Name: chloranylbenzene; 2-(2-chloranylphenoxy)-1-cyclopropyl-1-sulfanyl-3-(1,2,4-triazol-1-yl)propan-2-ol Openeye Name: chlorobenzene; 2-(2-chlorophenoxy)-1-cyclopropyl-1-sulfanyl-3-(1,2,4-triazol-1-yl)propan-2-ol CAS Name: chlorobenzene; 2-(2-chlorophenoxy)-1-cyclopropyl-1-mercapto-3-(1,2,4-triazol-1-yl)-2-propanol IUPAC Name: chlorobenzene; 2-(2-chlorophenoxy)-1-cyclopropyl-1-sulfanyl-3-(1,2,4-triazol-1-yl)propan-2-ol Traditional Name: chlorobenzene; 2-(2-chlorophenoxy)-1-cyclopropyl-1-mercapto-3-(1,2,4-triazol-1-yl)propan-2-ol Formula: C20H21Cl2N3O2S MolecularWeight: 438.37064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C(CN2C=NC=N2)(O)OC3=CC=CC=C3Cl)S.C1=CC=C(C=C1)Cl

Isomeric SMILES

C1CC1C(C(CN2C=NC=N2)(O)OC3=CC=CC=C3Cl)S.C1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H16ClN3O2S.C6H5Cl/c15-11-3-1-2-4-12(11)20-14(19,13(21)10-5-6-10)7-18-9-16-8-17-18;7-6-4-2-1-3-5-6/h1-4,8-10,13,19,21H,5-7H2;1-5H