(1R,6R)-3,4-dimethyl-6-[[(3-methylthiophen-2-yl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1R,6R)-3,4-dimethyl-6-[[(3-methylthiophen-2-yl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1R,6R)-3,4-dimethyl-6-[[(3-methylthiophene-2-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1R,6R)-3,4-dimethyl-6-[[[(3-methyl-2-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1R,6R)-3,4-dimethyl-6-[[(3-methylthiophene-2-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1R,6R)-3,4-dimethyl-6-[[(3-methylthiophene-2-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NNC(=O)C2=C(C=CS2)C)C(=O)O)C

Isomeric SMILES

CC1=C(C[C@H]([C@@H](C1)C(=O)NNC(=O)C2=C(C=CS2)C)C(=O)O)C

InChI

InChI=1S/C16H20N2O4S/c1-8-4-5-23-13(8)15(20)18-17-14(19)11-6-9(2)10(3)7-12(11)16(21)22/h4-5,11-12H,6-7H2,1-3H3,(H,17,19)(H,18,20)(H,21,22)/t11-,12-/m1/s1