5-[(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(3-butyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[(3-butyl-4-oxo-2-quinazolinyl)thio]methyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[(3-butyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[(3-butyl-4-keto-quinazolin-2-yl)thio]methyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide Formula: C23H23N5O2S2 MolecularWeight: 465.59102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C23H23N5O2S2/c1-3-4-13-28-22(30)17-7-5-6-8-18(17)25-23(28)31-14-19-26-27-21(32-19)20(29)24-16-11-9-15(2)10-12-16/h5-12H,3-4,13-14H2,1-2H3,(H,24,29)