potassium (Z,3Z)-3-(3-chloranyl-4-sulfanylidene-cyclohexa-2,5-dien-1-ylidene)-1-(4-ethanoylpiperazin-1-yl)prop-1-en-1-olate

Systemtic Name: potassium (Z,3Z)-3-(3-chloranyl-4-sulfanylidene-cyclohexa-2,5-dien-1-ylidene)-1-(4-ethanoylpiperazin-1-yl)prop-1-en-1-olate Openeye Name: potassium (Z,3Z)-1-(4-acetylpiperazin-1-yl)-3-(3-chloro-4-thioxo-cyclohexa-2,5-dien-1-ylidene)prop-1-en-1-olate CAS Name: potassium (Z,3Z)-1-(4-acetyl-1-piperazinyl)-3-(3-chloro-4-sulfanylidene-1-cyclohexa-2,5-dienylidene)-1-propen-1-olate IUPAC Name: potassium (Z,3Z)-1-(4-acetylpiperazin-1-yl)-3-(3-chloro-4-sulfanylidenecyclohexa-2,5-dien-1-ylidene)prop-1-en-1-olate Traditional Name: potassium (Z,3Z)-1-(4-acetylpiperazino)-3-(3-chloro-4-thioxo-cyclohexa-2,5-dien-1-ylidene)prop-1-en-1-olate Formula: C15H16ClKN2O2S MolecularWeight: 362.91604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=CC=C2C=CC(=S)C(=C2)Cl)[O-].[K+]

Isomeric SMILES

CC(=O)N1CCN(CC1)/C(=C/C=C\2/C=CC(=S)C(=C2)Cl)/[O-].[K+]

InChI

InChI=1S/C15H17ClN2O2S.K/c1-11(19)17-6-8-18(9-7-17)15(20)5-3-12-2-4-14(21)13(16)10-12;/h2-5,10,20H,6-9H2,1H3;/q;+1/p-1/b12-3-,15-5-;