N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]butanamide

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]butanamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]phenyl]butanamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylphenyl]butanamide Traditional Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]phenyl]butyramide Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H20N2O4S/c1-2-3-18(22)20-13-4-7-15(8-5-13)26-11-19(23)21-14-6-9-16-17(10-14)25-12-24-16/h4-10H,2-3,11-12H2,1H3,(H,20,22)(H,21,23)