8-methyl-2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 8-methyl-2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 8-methyl-2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 8-methyl-2-[[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 8-methyl-2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 8-methyl-2-[[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C20H19N5OS2 MolecularWeight: 409.52776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=C(S3)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=C(S3)NCCC4=CC=CC=C4

InChI

InChI=1S/C20H19N5OS2/c1-13-6-5-9-15-17(13)22-16(23-18(15)26)12-27-20-25-24-19(28-20)21-11-10-14-7-3-2-4-8-14/h2-9H,10-12H2,1H3,(H,21,24)(H,22,23,26)