(2S)-2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-N-propyl-propanamide CAS Name: (2S)-2-[[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-N-propylpropanamide Traditional Name: (2S)-2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-N-propyl-propionamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H21N3O2S/c1-3-10-17-16(21)11(2)18-14(20)8-9-15-19-12-6-4-5-7-13(12)22-15/h4-7,11H,3,8-10H2,1-2H3,(H,17,21)(H,18,20)/t11-/m0/s1