2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C17H13N5OS2 MolecularWeight: 367.44802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C17H13N5OS2/c23-15-12-8-4-5-9-13(12)19-14(20-15)10-24-17-22-21-16(25-17)18-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,21)(H,19,20,23)