N-[4-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]phenyl]propanamide CAS Name: N-[4-[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]acetyl]phenyl]propionamide Formula: C18H15ClN2O2S2 MolecularWeight: 390.9069

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H15ClN2O2S2/c1-2-17(23)20-13-6-3-11(4-7-13)15(22)10-24-18-21-14-9-12(19)5-8-16(14)25-18/h3-9H,2,10H2,1H3,(H,20,23)