N-aminocarbonyl-2-[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-aminocarbonyl-2-[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-carbamoyl-2-[4-oxo-3-(4-sec-butylphenyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: 2-[[3-(4-butan-2-ylphenyl)-4-oxo-2-quinazolinyl]thio]-N-carbamoylpropanamide IUPAC Name: 2-[3-(4-butan-2-ylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-carbamoylpropanamide Traditional Name: N-carbamoyl-2-[[4-keto-3-(4-sec-butylphenyl)quinazolin-2-yl]thio]propionamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)N

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)N

InChI

InChI=1S/C22H24N4O3S/c1-4-13(2)15-9-11-16(12-10-15)26-20(28)17-7-5-6-8-18(17)24-22(26)30-14(3)19(27)25-21(23)29/h5-14H,4H2,1-3H3,(H3,23,25,27,29)