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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=C(N3)C(=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=C(N3)C(=CC=C4)C)C

InChI

InChI=1S/C20H19N5OS2/c1-11-7-8-14(9-13(11)3)21-19-24-25-20(28-19)27-10-16-22-17-12(2)5-4-6-15(17)18(26)23-16/h4-9H,10H2,1-3H3,(H,21,24)(H,22,23,26)