N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(2,5-dimethylphenoxy)-N-methyl-propanamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(2,5-dimethylphenoxy)-N-methyl-propanamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(2,5-dimethylphenoxy)-N-methyl-propanamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(2,5-dimethylphenoxy)-N-methylpropanamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(2,5-dimethylphenoxy)-N-methylpropanamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(2,5-dimethylphenoxy)-N-methyl-propionamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)N(C)C(C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)N(C)[C@H](C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H24N2O2S/c1-14-9-10-15(2)18(13-14)25-12-11-20(24)23(4)16(3)21-22-17-7-5-6-8-19(17)26-21/h5-10,13,16H,11-12H2,1-4H3/t16-/m1/s1