N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C18H22N2O5S2 MolecularWeight: 410.50768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N2O5S2/c1-13(14-7-8-15-16(11-14)25-12-24-15)19-17(21)5-3-9-20(2)27(22,23)18-6-4-10-26-18/h4,6-8,10-11,13H,3,5,9,12H2,1-2H3,(H,19,21)