N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-chloranyl-2-methyl-phenoxy)butanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-chloranyl-2-methyl-phenoxy)butanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-chloro-2-methyl-phenoxy)butanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-chloro-2-methylphenoxy)butanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-chloro-2-methylphenoxy)butanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-chloro-2-methyl-phenoxy)butyramide Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H21ClN2O2S/c1-14-13-15(21)8-9-17(14)25-12-4-7-19(24)22-11-10-20-23-16-5-2-3-6-18(16)26-20/h2-3,5-6,8-9,13H,4,7,10-12H2,1H3,(H,22,24)