4-[(5-prop-2-enyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(5-prop-2-enyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[(5-allyl-6-thioxo-1,3,5-thiadiazinan-3-yl)methyl]cyclohexanecarboxylic acid CAS Name: 4-[(5-prop-2-enyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[(5-prop-2-enyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[(5-allyl-6-thioxo-1,3,5-thiadiazinan-3-yl)methyl]cyclohexanecarboxylic acid Formula: C14H22N2O2S2 MolecularWeight: 314.46668

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CN(CSC1=S)CC2CCC(CC2)C(=O)O

Isomeric SMILES

C=CCN1CN(CSC1=S)CC2CCC(CC2)C(=O)O

InChI

InChI=1S/C14H22N2O2S2/c1-2-7-16-9-15(10-20-14(16)19)8-11-3-5-12(6-4-11)13(17)18/h2,11-12H,1,3-10H2,(H,17,18)