N-[2-[2-(2-chloranylphenoxy)ethylsulfanyl]-1,3-benzothiazol-6-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-[2-(2-chloranylphenoxy)ethylsulfanyl]-1,3-benzothiazol-6-yl]-2,2-dimethyl-propanamide Openeye Name: N-[2-[2-(2-chlorophenoxy)ethylsulfanyl]-1,3-benzothiazol-6-yl]-2,2-dimethyl-propanamide CAS Name: N-[2-[2-(2-chlorophenoxy)ethylthio]-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide IUPAC Name: N-[2-[2-(2-chlorophenoxy)ethylsulfanyl]-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide Traditional Name: N-[2-[2-(2-chlorophenoxy)ethylthio]-1,3-benzothiazol-6-yl]-2,2-dimethyl-propionamide Formula: C20H21ClN2O2S2 MolecularWeight: 420.97594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCCOC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCCOC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN2O2S2/c1-20(2,3)18(24)22-13-8-9-15-17(12-13)27-19(23-15)26-11-10-25-16-7-5-4-6-14(16)21/h4-9,12H,10-11H2,1-3H3,(H,22,24)