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6,8-bis(bromanyl)-2-methyl-3-[5-[3-[(2-methylphenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]quinazolin-4-one

6,8-bis(bromanyl)-2-methyl-3-[5-[3-[(2-methylphenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]quinazolin-4-one

Systemtic Name:6,8-bis(bromanyl)-2-methyl-3-[5-[3-[(2-methylphenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]quinazolin-4-one
Openeye Name:6,8-dibromo-3-[5-[2-hydroxy-3-(2-methylanilino)propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one
CAS Name:6,8-dibromo-3-[5-[[2-hydroxy-3-(2-methylanilino)propyl]thio]-1,3,4-thiadiazol-2-yl]-2-methyl-4-quinazolinone
IUPAC Name:6,8-dibromo-3-[5-[2-hydroxy-3-(2-methylanilino)propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one
Traditional Name:6,8-dibromo-3-[5-[[2-hydroxy-3-(o-toluidino)propyl]thio]-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one
Formula: C21H19Br2N5O2S2
MolecularWeight: 597.34586
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NCC(CSC2=NN=C(S2)N3C(=NC4=C(C=C(C=C4C3=O)Br)Br)C)O


Isomeric SMILES

CC1=CC=CC=C1NCC(CSC2=NN=C(S2)N3C(=NC4=C(C=C(C=C4C3=O)Br)Br)C)O


InChI

InChI=1S/C21H19Br2N5O2S2/c1-11-5-3-4-6-17(11)24-9-14(29)10-31-21-27-26-20(32-21)28-12(2)25-18-15(19(28)30)7-13(22)8-16(18)23/h3-8,14,24,29H,9-10H2,1-2H3


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