6-chloranyl-4-[2-(3-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione

Systemtic Name: 6-chloranyl-4-[2-(3-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione Openeye Name: 6-chloro-4-[2-(3-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione CAS Name: 6-chloro-4-[2-(3-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione IUPAC Name: 6-chloro-4-[2-(3-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione Traditional Name: 6-chloro-4-[2-(3-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione Formula: C17H10ClF3N2OS MolecularWeight: 382.78731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C#CC2(C3=C(C=CC(=C3)Cl)NC(=S)N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)O)C#CC2(C3=C(C=CC(=C3)Cl)NC(=S)N2)C(F)(F)F

InChI

InChI=1S/C17H10ClF3N2OS/c18-11-4-5-14-13(9-11)16(17(19,20)21,23-15(25)22-14)7-6-10-2-1-3-12(24)8-10/h1-5,8-9,24H,(H2,22,23,25)