(3S)-3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one

Systemtic Name: (3S)-3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Openeye Name: (3S)-3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]tetrahydrofuran-2-one CAS Name: (3S)-3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]-2-oxolanone IUPAC Name: (3S)-3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Traditional Name: (3S)-3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]tetrahydrofuran-2-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SC4CCOC4=O

Isomeric SMILES

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)S[C@H]4CCOC4=O

InChI

InChI=1S/C18H21N3O2S/c22-17-15(11-12-23-17)24-18-19-16(13-7-3-1-4-8-13)21(20-18)14-9-5-2-6-10-14/h2,5-6,9-10,13,15H,1,3-4,7-8,11-12H2/t15-/m0/s1