4-(1H-benzimidazol-2-ylsulfanyl)-N-pentan-3-yl-butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-pentan-3-yl-butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(1-ethylpropyl)butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-pentan-3-ylbutanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-pentan-3-ylbutanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-(1-ethylpropyl)butyramide Formula: C16H23N3OS MolecularWeight: 305.43832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CCCSC1=NC2=CC=CC=C2N1

Isomeric SMILES

CCC(CC)NC(=O)CCCSC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C16H23N3OS/c1-3-12(4-2)17-15(20)10-7-11-21-16-18-13-8-5-6-9-14(13)19-16/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3,(H,17,20)(H,18,19)