N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanamide

Systemtic Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanamide Openeye Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4-(2-thenoyl)piperazino]acetamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCO2)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H25N3O4S/c1-15(16-4-5-17-18(13-16)28-11-10-27-17)22-20(25)14-23-6-8-24(9-7-23)21(26)19-3-2-12-29-19/h2-5,12-13,15H,6-11,14H2,1H3,(H,22,25)/t15-/m0/s1