N-[2-(3-hydroxyphenyl)ethyl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-[2-(3-hydroxyphenyl)ethyl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-[2-(3-hydroxyphenyl)ethyl]-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-[2-(3-hydroxyphenyl)ethyl]-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-[2-(3-hydroxyphenyl)ethyl]-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: N-[2-(3-hydroxyphenyl)ethyl]-4-keto-1H-quinazoline-2-carbothioamide Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NCCC3=CC(=CC=C3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NCCC3=CC(=CC=C3)O

InChI

InChI=1S/C17H15N3O2S/c21-12-5-3-4-11(10-12)8-9-18-17(23)15-19-14-7-2-1-6-13(14)16(22)20-15/h1-7,10,21H,8-9H2,(H,18,23)(H,19,20,22)