6-[1H-indol-2-yl(oxidanyl)methyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile

Systemtic Name: 6-[1H-indol-2-yl(oxidanyl)methyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Openeye Name: 6-[hydroxy(1H-indol-2-yl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile CAS Name: 6-[hydroxy(1H-indol-2-yl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile IUPAC Name: 6-[hydroxy(1H-indol-2-yl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Traditional Name: 6-[hydroxy(1H-indol-2-yl)methyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C3=CC4=CC=CC=C4N3)O)C#N)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C3=CC4=CC=CC=C4N3)O)C#N)C

InChI

InChI=1S/C17H17N3O2S/c1-17(2)12(8-18)20-15(22)13(16(20)23-17)14(21)11-7-9-5-3-4-6-10(9)19-11/h3-7,12-14,16,19,21H,1-2H3