(2S)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-(1H-benzimidazol-2-ylthio)acetyl]amino]-N-ethyl-propionamide Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=NC2=CC=CC=C2N1

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C14H18N4O2S/c1-3-15-13(20)9(2)16-12(19)8-21-14-17-10-6-4-5-7-11(10)18-14/h4-7,9H,3,8H2,1-2H3,(H,15,20)(H,16,19)(H,17,18)/t9-/m0/s1