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

Systemtic Name: 6-chloranyl-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]-6-chloro-1H-quinazolin-4-one CAS Name: 2-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-6-chloro-1H-quinazolin-4-one IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-6-chloro-1H-quinazolin-4-one Traditional Name: 2-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-6-chloro-1H-quinazolin-4-one Formula: C17H12ClN5OS2 MolecularWeight: 401.89308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C17H12ClN5OS2/c18-10-6-7-13-12(8-10)15(24)21-14(20-13)9-25-17-23-22-16(26-17)19-11-4-2-1-3-5-11/h1-8H,9H2,(H,19,22)(H,20,21,24)