2-[[8-(trifluoromethyl)quinolin-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[[8-(trifluoromethyl)-4-quinolyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[[8-(trifluoromethyl)-4-quinolinyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[[8-(trifluoromethyl)-4-quinolyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C19H14F3N3S MolecularWeight: 373.39477

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC3=C4C=CC=C(C4=NC=C3)C(F)(F)F)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC3=C4C=CC=C(C4=NC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C19H14F3N3S/c20-19(21,22)14-6-3-5-12-15(8-9-24-17(12)14)25-18-13(10-23)11-4-1-2-7-16(11)26-18/h3,5-6,8-9H,1-2,4,7H2,(H,24,25)