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

Systemtic Name: 2-[[5-[(3-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[[5-(3-bromoanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-chloro-1H-quinazolin-4-one CAS Name: 2-[[[5-(3-bromoanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-6-chloro-1H-quinazolin-4-one IUPAC Name: 2-[[5-(3-bromoanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-chloro-1H-quinazolin-4-one Traditional Name: 2-[[[5-(3-bromoanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-6-chloro-1H-quinazolin-4-one Formula: C17H11BrClN5OS2 MolecularWeight: 480.78914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11BrClN5OS2/c18-9-2-1-3-11(6-9)20-16-23-24-17(27-16)26-8-14-21-13-5-4-10(19)7-12(13)15(25)22-14/h1-7H,8H2,(H,20,23)(H,21,22,25)