N-[4-(tert-butylcarbamoyl)phenyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)NC(C)(C)C)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)NC(C)(C)C)NC1=S

InChI

InChI=1S/C22H24N4O3S/c1-5-26-20(29)16-11-8-14(12-17(16)24-21(26)30)18(27)23-15-9-6-13(7-10-15)19(28)25-22(2,3)4/h6-12H,5H2,1-4H3,(H,23,27)(H,24,30)(H,25,28)