S-[(3Z)-3-[[1-(1,3-thiazol-4-ylmethyl)pyrazol-3-yl]methylidene]piperidin-4-yl] ethanethioate

Systemtic Name: S-[(3Z)-3-[[1-(1,3-thiazol-4-ylmethyl)pyrazol-3-yl]methylidene]piperidin-4-yl] ethanethioate Openeye Name: S-[(3Z)-3-[[1-(thiazol-4-ylmethyl)pyrazol-3-yl]methylene]-4-piperidyl] ethanethioate CAS Name: ethanethioic acid S-[(3Z)-3-[[1-(4-thiazolylmethyl)-3-pyrazolyl]methylidene]-4-piperidinyl] ester IUPAC Name: S-[(3Z)-3-[[1-(1,3-thiazol-4-ylmethyl)pyrazol-3-yl]methylidene]piperidin-4-yl] ethanethioate Traditional Name: ethanethioic acid S-[(3Z)-3-[[1-(thiazol-4-ylmethyl)pyrazol-3-yl]methylene]-4-piperidyl] ester Formula: C15H18N4OS2 MolecularWeight: 334.45962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CCNCC1=CC2=NN(C=C2)CC3=CSC=N3

Isomeric SMILES

CC(=O)SC\1CCNC/C1=C/C2=NN(C=C2)CC3=CSC=N3

InChI

InChI=1S/C15H18N4OS2/c1-11(20)22-15-2-4-16-7-12(15)6-13-3-5-19(18-13)8-14-9-21-10-17-14/h3,5-6,9-10,15-16H,2,4,7-8H2,1H3/b12-6-