N-(3,3-dimethyl-1-phenyl-butyl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-(3,3-dimethyl-1-phenyl-butyl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-(3,3-dimethyl-1-phenyl-butyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-(3,3-dimethyl-1-phenylbutyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(3,3-dimethyl-1-phenylbutyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(3,3-dimethyl-1-phenyl-butyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C1=CC=CC=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC(C)(C)CC(C1=CC=CC=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C23H27N3O2S/c1-23(2,3)15-19(16-9-5-4-6-10-16)24-20(27)13-14-26-21(28)17-11-7-8-12-18(17)25-22(26)29/h4-12,19H,13-15H2,1-3H3,(H,24,27)(H,25,29)