N-tert-butyl-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-tert-butyl-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-tert-butyl-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-tert-butyl-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-tert-butyl-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-tert-butyl-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C16H21N3O2S/c1-10(13(20)18-16(2,3)4)22-15-17-12-9-7-6-8-11(12)14(21)19(15)5/h6-10H,1-5H3,(H,18,20)