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

Systemtic Name: 6-chloranyl-4-[2-(2-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione Openeye Name: 6-chloro-4-[2-(2-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione CAS Name: 6-chloro-4-[2-(2-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione IUPAC Name: 6-chloro-4-[2-(2-hydroxyphenyl)ethynyl]-4-(trifluoromethyl)-1,3-dihydroquinazoline-2-thione Traditional Name: 6-chloro-4-[2-(2-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=C(C(=C1)C#CC2(C3=C(C=CC(=C3)Cl)NC(=S)N2)C(F)(F)F)O

Isomeric SMILES

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

InChI

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