4-sulfanylidene-2-(trifluoromethyl)-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]indolizine-10-carbonitrile

Systemtic Name: 4-sulfanylidene-2-(trifluoromethyl)-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]indolizine-10-carbonitrile Openeye Name: 4-thioxo-2-(trifluoromethyl)-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]indolizine-10-carbonitrile CAS Name: 4-sulfanylidene-2-(trifluoromethyl)-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]indolizine-10-carbonitrile IUPAC Name: 4-sulfanylidene-2-(trifluoromethyl)-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]indolizine-10-carbonitrile Traditional Name: 4-thioxo-2-(trifluoromethyl)-6,7,8,9-tetrahydro-1H-pyrimid[4,5-b]indolizine-10-carbonitrile Formula: C12H9F3N4S MolecularWeight: 298.28687

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C3=C2C(=S)N=C(N3)C(F)(F)F)C#N)C1

Isomeric SMILES

C1CCN2C(=C(C3=C2C(=S)N=C(N3)C(F)(F)F)C#N)C1

InChI

InChI=1S/C12H9F3N4S/c13-12(14,15)11-17-8-6(5-16)7-3-1-2-4-19(7)9(8)10(20)18-11/h1-4H2,(H,17,18,20)