(5S)-5-thiophen-2-yl-3-(1H-1,2,4-triazol-5-ylamino)cyclohex-2-en-1-one

Systemtic Name: (5S)-5-thiophen-2-yl-3-(1H-1,2,4-triazol-5-ylamino)cyclohex-2-en-1-one Openeye Name: (5S)-5-(2-thienyl)-3-(1H-1,2,4-triazol-5-ylamino)cyclohex-2-en-1-one CAS Name: (5S)-5-thiophen-2-yl-3-(1H-1,2,4-triazol-5-ylamino)-1-cyclohex-2-enone IUPAC Name: (5S)-5-thiophen-2-yl-3-(1H-1,2,4-triazol-5-ylamino)cyclohex-2-en-1-one Traditional Name: (5S)-5-(2-thienyl)-3-(1H-1,2,4-triazol-5-ylamino)cyclohex-2-en-1-one Formula: C12H12N4OS MolecularWeight: 260.31488

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C=C1NC2=NC=NN2)C3=CC=CS3

Isomeric SMILES

C1[C@@H](CC(=O)C=C1NC2=NC=NN2)C3=CC=CS3

InChI

InChI=1S/C12H12N4OS/c17-10-5-8(11-2-1-3-18-11)4-9(6-10)15-12-13-7-14-16-12/h1-3,6-8H,4-5H2,(H2,13,14,15,16)/t8-/m0/s1