N-(1,3-benzodioxol-5-yl)-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(phenylmethylsulfanyl)butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-benzylsulfanyl-butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(phenylmethylthio)butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-benzylsulfanylbutanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(benzylthio)butyramide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCSCC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCSCC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3S/c20-18(7-4-10-23-12-14-5-2-1-3-6-14)19-15-8-9-16-17(11-15)22-13-21-16/h1-3,5-6,8-9,11H,4,7,10,12-13H2,(H,19,20)