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6-bromanyl-3-[5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one

6-bromanyl-3-[5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one

Systemtic Name:6-bromanyl-3-[5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one
Openeye Name:6-bromo-3-[5-[3-(4-chloroanilino)-2-hydroxy-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one
CAS Name:6-bromo-3-[5-[[3-(4-chloroanilino)-2-hydroxypropyl]thio]-1,3,4-thiadiazol-2-yl]-2-methyl-4-quinazolinone
IUPAC Name:6-bromo-3-[5-[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one
Traditional Name:6-bromo-3-[5-[[3-(4-chloroanilino)-2-hydroxy-propyl]thio]-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one
Formula: C20H17BrClN5O2S2
MolecularWeight: 538.86828
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=C(C=C4)Cl)O


Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=C(C=C4)Cl)O


InChI

InChI=1S/C20H17BrClN5O2S2/c1-11-24-17-7-2-12(21)8-16(17)18(29)27(11)19-25-26-20(31-19)30-10-15(28)9-23-14-5-3-13(22)4-6-14/h2-8,15,23,28H,9-10H2,1H3


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Name: 6-bromanyl-3-[5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one

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