N-[(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-4-chloranyl-benzamide

Systemtic Name: N-[(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-4-chloranyl-benzamide Openeye Name: N-[(3-amino-4-oxo-quinazolin-2-yl)sulfanylmethyl]-4-chloro-benzamide CAS Name: N-[[(3-amino-4-oxo-2-quinazolinyl)thio]methyl]-4-chlorobenzamide IUPAC Name: N-[(3-amino-4-oxoquinazolin-2-yl)sulfanylmethyl]-4-chlorobenzamide Traditional Name: N-[[(3-amino-4-keto-quinazolin-2-yl)thio]methyl]-4-chloro-benzamide Formula: C16H13ClN4O2S MolecularWeight: 360.81802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCNC(=O)C3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCNC(=O)C3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C16H13ClN4O2S/c17-11-7-5-10(6-8-11)14(22)19-9-24-16-20-13-4-2-1-3-12(13)15(23)21(16)18/h1-8H,9,18H2,(H,19,22)