(1S,2S)-2-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2S)-2-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2S)-2-[(3-carbamoyl-4,5-dimethyl-2-thienyl)carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2S)-2-[[(3-carbamoyl-4,5-dimethyl-2-thiophenyl)amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2S)-2-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-[(3-carbamoyl-4,5-dimethyl-2-thienyl)carbamoyl]cyclohexanecarboxylate Formula: C15H19N2O4S- MolecularWeight: 323.38736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2CCCCC2C(=O)[O-])C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])C

InChI

InChI=1S/C15H20N2O4S/c1-7-8(2)22-14(11(7)12(16)18)17-13(19)9-5-3-4-6-10(9)15(20)21/h9-10H,3-6H2,1-2H3,(H2,16,18)(H,17,19)(H,20,21)/p-1/t9-,10-/m0/s1