4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentyl-benzamide

Systemtic Name: 4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentyl-benzamide Openeye Name: 4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-pentyl-benzamide CAS Name: 4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentylbenzamide IUPAC Name: 4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentylbenzamide Traditional Name: N-amyl-4-(4-keto-2-thioxo-1H-quinazolin-3-yl)benzamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCCCCNC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C20H21N3O2S/c1-2-3-6-13-21-18(24)14-9-11-15(12-10-14)23-19(25)16-7-4-5-8-17(16)22-20(23)26/h4-5,7-12H,2-3,6,13H2,1H3,(H,21,24)(H,22,26)