(E)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C20H19ClN2O4S MolecularWeight: 418.89386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC3=C(C(=C2)Cl)OCCO3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCCO3)C(=O)C4=CC=CS4

InChI

InChI=1S/C20H19ClN2O4S/c21-15-12-14(13-16-19(15)27-10-9-26-16)3-4-18(24)22-5-7-23(8-6-22)20(25)17-2-1-11-28-17/h1-4,11-13H,5-10H2/b4-3+