3-acetamido-N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-chlorophenyl)propanamide

Systemtic Name: 3-acetamido-N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-chlorophenyl)propanamide Openeye Name: 3-acetamido-N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-chlorophenyl)propanamide CAS Name: 3-acetamido-N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-chlorophenyl)propanamide IUPAC Name: 3-acetamido-N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-chlorophenyl)propanamide Traditional Name: 3-acetamido-N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-chlorophenyl)propionamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NCCC1=NC2=CC=CC=C2S1)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC(CC(=O)NCCC1=NC2=CC=CC=C2S1)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-13(25)23-17(14-6-8-15(21)9-7-14)12-19(26)22-11-10-20-24-16-4-2-3-5-18(16)27-20/h2-9,17H,10-12H2,1H3,(H,22,26)(H,23,25)