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

Systemtic Name: N-(3-methylbutyl)-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzamide Openeye Name: N-isopentyl-4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzamide CAS Name: N-(3-methylbutyl)-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzamide IUPAC Name: N-(3-methylbutyl)-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzamide Traditional Name: N-isoamyl-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S/c1-13(2)11-12-21-18(24)14-7-9-15(10-8-14)23-19(25)16-5-3-4-6-17(16)22-20(23)26/h3-10,13H,11-12H2,1-2H3,(H,21,24)(H,22,26)