N-(3-methylphenyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-methylphenyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(m-tolyl)propanamide CAS Name: N-(3-methylphenyl)-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3-methylphenyl)-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-(m-tolyl)propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C(C)C

InChI

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