(2S)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]cyclohexan-1-one Openeye Name: (2S)-2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]cyclohexanone CAS Name: (2S)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-cyclohexanone IUPAC Name: (2S)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]cyclohexan-1-one Traditional Name: (2S)-2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]cyclohexanone Formula: C14H17N3OS2 MolecularWeight: 307.43428

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2CCCCC2=O)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1S[C@H]2CCCCC2=O)C3=CC=CS3

InChI

InChI=1S/C14H17N3OS2/c1-2-17-13(12-8-5-9-19-12)15-16-14(17)20-11-7-4-3-6-10(11)18/h5,8-9,11H,2-4,6-7H2,1H3/t11-/m0/s1