N-[2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: N-[2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: N-[2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxo-ethyl]-N-methyl-benzamide CAS Name: N-[2-[2-[[2-(1-cyclohexenyl)ethylamino]-sulfanylidenemethyl]-1-pyrazolidinyl]-2-oxoethyl]-N-methylbenzamide IUPAC Name: N-[2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxoethyl]-N-methylbenzamide Traditional Name: N-[2-[2-[2-(cyclohexen-1-yl)ethylthiocarbamoyl]pyrazolidin-1-yl]-2-keto-ethyl]-N-methyl-benzamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCN1C(=S)NCCC2=CCCCC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)N1CCCN1C(=S)NCCC2=CCCCC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H30N4O2S/c1-24(21(28)19-11-6-3-7-12-19)17-20(27)25-15-8-16-26(25)22(29)23-14-13-18-9-4-2-5-10-18/h3,6-7,9,11-12H,2,4-5,8,10,13-17H2,1H3,(H,23,29)