2-methyl-3-[5-(2-oxidanyl-3-phenylazanyl-propyl)sulfanyl-1,3,4-thiadiazol-2-yl]quinazolin-4-one

Systemtic Name: 2-methyl-3-[5-(2-oxidanyl-3-phenylazanyl-propyl)sulfanyl-1,3,4-thiadiazol-2-yl]quinazolin-4-one Openeye Name: 3-[5-(3-anilino-2-hydroxy-propyl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one CAS Name: 3-[5-[(3-anilino-2-hydroxypropyl)thio]-1,3,4-thiadiazol-2-yl]-2-methyl-4-quinazolinone IUPAC Name: 3-[5-(3-anilino-2-hydroxypropyl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one Traditional Name: 3-[5-[(3-anilino-2-hydroxy-propyl)thio]-1,3,4-thiadiazol-2-yl]-2-methyl-quinazolin-4-one Formula: C20H19N5O2S2 MolecularWeight: 425.52716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=CC=C4)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=CC=C4)O

InChI

InChI=1S/C20H19N5O2S2/c1-13-22-17-10-6-5-9-16(17)18(27)25(13)19-23-24-20(29-19)28-12-15(26)11-21-14-7-3-2-4-8-14/h2-10,15,21,26H,11-12H2,1H3