N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(4-chloranylphenoxy)-2-methyl-propanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(4-chloranylphenoxy)-2-methyl-propanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(4-chlorophenoxy)-2-methyl-propanamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(4-chlorophenoxy)-2-methylpropanamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(4-chlorophenoxy)-2-methylpropanamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(4-chlorophenoxy)-2-methyl-propionamide Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NCCCC1=NC2=CC=CC=C2S1)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)NCCCC1=NC2=CC=CC=C2S1)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O2S/c1-20(2,25-15-11-9-14(21)10-12-15)19(24)22-13-5-8-18-23-16-6-3-4-7-17(16)26-18/h3-4,6-7,9-12H,5,8,13H2,1-2H3,(H,22,24)