(1S,6S)-3,4-dimethyl-6-[[(3-methylthiophen-2-yl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-3,4-dimethyl-6-[[(3-methylthiophen-2-yl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-3,4-dimethyl-6-[[(3-methylthiophene-2-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-3,4-dimethyl-6-[[[(3-methyl-2-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-3,4-dimethyl-6-[[(3-methylthiophene-2-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-3,4-dimethyl-6-[[(3-methylthiophene-2-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C16H19N2O4S- MolecularWeight: 335.39806

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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)/p-1/t11-,12-/m0/s1