4-[4,4-dimethyl-2-(trifluoromethyl)-1,2-dihydro-3,1-benzoxazin-6-yl]thiophene-2-carbonitrile

Systemtic Name: 4-[4,4-dimethyl-2-(trifluoromethyl)-1,2-dihydro-3,1-benzoxazin-6-yl]thiophene-2-carbonitrile Openeye Name: 4-[4,4-dimethyl-2-(trifluoromethyl)-1,2-dihydro-3,1-benzoxazin-6-yl]thiophene-2-carbonitrile CAS Name: 4-[4,4-dimethyl-2-(trifluoromethyl)-1,2-dihydro-3,1-benzoxazin-6-yl]-2-thiophenecarbonitrile IUPAC Name: 4-[4,4-dimethyl-2-(trifluoromethyl)-1,2-dihydro-3,1-benzoxazin-6-yl]thiophene-2-carbonitrile Traditional Name: 4-[4,4-dimethyl-2-(trifluoromethyl)-1,2-dihydro-3,1-benzoxazin-6-yl]thiophene-2-carbonitrile Formula: C16H13F3N2OS MolecularWeight: 338.34743

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CSC(=C3)C#N)NC(O1)C(F)(F)F)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CSC(=C3)C#N)NC(O1)C(F)(F)F)C

InChI

InChI=1S/C16H13F3N2OS/c1-15(2)12-6-9(10-5-11(7-20)23-8-10)3-4-13(12)21-14(22-15)16(17,18)19/h3-6,8,14,21H,1-2H3