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

Systemtic Name: 3-[5-[3-[(4-chlorophenyl)amino]-2-oxidanyl-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-iodanyl-2-methyl-quinazolin-4-one Openeye Name: 3-[5-[3-(4-chloroanilino)-2-hydroxy-propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-iodo-2-methyl-quinazolin-4-one CAS Name: 3-[5-[[3-(4-chloroanilino)-2-hydroxypropyl]thio]-1,3,4-thiadiazol-2-yl]-6-iodo-2-methyl-4-quinazolinone IUPAC Name: 3-[5-[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-iodo-2-methylquinazolin-4-one Traditional Name: 3-[5-[[3-(4-chloroanilino)-2-hydroxy-propyl]thio]-1,3,4-thiadiazol-2-yl]-6-iodo-2-methyl-quinazolin-4-one Formula: C20H17ClIN5O2S2 MolecularWeight: 585.86875

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClIN5O2S2/c1-11-24-17-7-4-13(22)8-16(17)18(29)27(11)19-25-26-20(31-19)30-10-15(28)9-23-14-5-2-12(21)3-6-14/h2-8,15,23,28H,9-10H2,1H3