3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylisothiochromen-1-one

Systemtic Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylisothiochromen-1-one Openeye Name: 3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]isothiochromen-1-one CAS Name: 3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-2-benzothiopyran-1-one IUPAC Name: 3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]isothiochromen-1-one Traditional Name: 3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]isothiochromen-1-one Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

C1CN(CCN1CCO)C(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C16H18N2O3S/c19-10-9-17-5-7-18(8-6-17)15(20)14-11-12-3-1-2-4-13(12)16(21)22-14/h1-4,11,19H,5-10H2