N-(2-ethyl-6-methyl-phenyl)-3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-3-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-3-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-3-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C)C

InChI

InChI=1S/C21H23N3O2S/c1-4-15-9-7-8-14(2)19(15)23-18(25)12-13-27-21-22-17-11-6-5-10-16(17)20(26)24(21)3/h5-11H,4,12-13H2,1-3H3,(H,23,25)