3-(1,3-benzodioxol-5-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-2-propen-1-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-thienylsulfonyl)piperazino]prop-2-en-1-one Formula: C18H18N2O5S2 MolecularWeight: 406.47592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C=CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H18N2O5S2/c21-17(6-4-14-3-5-15-16(12-14)25-13-24-15)19-7-9-20(10-8-19)27(22,23)18-2-1-11-26-18/h1-6,11-12H,7-10,13H2