N-(2-butan-2-ylphenyl)-2-quinazolin-4-ylsulfanyl-propanamide

Systemtic Name: N-(2-butan-2-ylphenyl)-2-quinazolin-4-ylsulfanyl-propanamide Openeye Name: 2-quinazolin-4-ylsulfanyl-N-(2-sec-butylphenyl)propanamide CAS Name: N-(2-butan-2-ylphenyl)-2-(4-quinazolinylthio)propanamide IUPAC Name: N-(2-butan-2-ylphenyl)-2-quinazolin-4-ylsulfanylpropanamide Traditional Name: 2-(quinazolin-4-ylthio)-N-(2-sec-butylphenyl)propionamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C21H23N3OS/c1-4-14(2)16-9-5-8-12-19(16)24-20(25)15(3)26-21-17-10-6-7-11-18(17)22-13-23-21/h5-15H,4H2,1-3H3,(H,24,25)