3-(4-ethylpiperazin-1-yl)carbonylisothiochromen-1-one

Systemtic Name: 3-(4-ethylpiperazin-1-yl)carbonylisothiochromen-1-one Openeye Name: 3-(4-ethylpiperazine-1-carbonyl)isothiochromen-1-one CAS Name: 3-[(4-ethyl-1-piperazinyl)-oxomethyl]-2-benzothiopyran-1-one IUPAC Name: 3-(4-ethylpiperazine-1-carbonyl)isothiochromen-1-one Traditional Name: 3-(4-ethylpiperazine-1-carbonyl)isothiochromen-1-one Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C16H18N2O2S/c1-2-17-7-9-18(10-8-17)15(19)14-11-12-5-3-4-6-13(12)16(20)21-14/h3-6,11H,2,7-10H2,1H3