(2S)-2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methylphenyl)propanamide

Systemtic Name: (2S)-2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methylphenyl)propanamide Openeye Name: (2S)-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(m-tolyl)propanamide CAS Name: (2S)-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(3-methylphenyl)propanamide IUPAC Name: (2S)-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methylphenyl)propanamide Traditional Name: (2S)-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(m-tolyl)propionamide Formula: C17H15ClN2OS2 MolecularWeight: 362.8968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)SC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C17H15ClN2OS2/c1-10-4-3-5-13(8-10)19-16(21)11(2)22-17-20-14-9-12(18)6-7-15(14)23-17/h3-9,11H,1-2H3,(H,19,21)/t11-/m0/s1