4-azanyl-5-(4-bromophenyl)carbonyl-2-[[3-(trifluoromethyl)phenyl]amino]thiophene-3-carbonitrile

Systemtic Name: 4-azanyl-5-(4-bromophenyl)carbonyl-2-[[3-(trifluoromethyl)phenyl]amino]thiophene-3-carbonitrile Openeye Name: 4-amino-5-(4-bromobenzoyl)-2-[3-(trifluoromethyl)anilino]thiophene-3-carbonitrile CAS Name: 4-amino-5-[(4-bromophenyl)-oxomethyl]-2-[3-(trifluoromethyl)anilino]-3-thiophenecarbonitrile IUPAC Name: 4-amino-5-(4-bromobenzoyl)-2-[3-(trifluoromethyl)anilino]thiophene-3-carbonitrile Traditional Name: 4-amino-5-(4-bromobenzoyl)-2-[3-(trifluoromethyl)anilino]thiophene-3-carbonitrile Formula: C19H11BrF3N3OS MolecularWeight: 466.27435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C(=C(S2)C(=O)C3=CC=C(C=C3)Br)N)C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C(=C(S2)C(=O)C3=CC=C(C=C3)Br)N)C#N)C(F)(F)F

InChI

InChI=1S/C19H11BrF3N3OS/c20-12-6-4-10(5-7-12)16(27)17-15(25)14(9-24)18(28-17)26-13-3-1-2-11(8-13)19(21,22)23/h1-8,26H,25H2