(1S,6R)-6-[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)C3CC=CCC3C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)O

InChI

InChI=1S/C16H21N3O3S/c20-13(11-8-4-5-9-12(11)15(21)22)17-16-19-18-14(23-16)10-6-2-1-3-7-10/h4-5,10-12H,1-3,6-9H2,(H,21,22)(H,17,19,20)/t11-,12+/m1/s1