2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide

Systemtic Name: 2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide Openeye Name: 2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide CAS Name: 2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]-N-(4-ethoxyphenyl)propanamide IUPAC Name: 2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide Traditional Name: 2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]-N-p-phenetyl-propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=C(C=C3)C)C(=O)N2C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=C(C=C3)C)C(=O)N2C

InChI

InChI=1S/C21H23N3O3S/c1-5-27-16-9-7-15(8-10-16)22-19(25)14(3)28-21-23-18-11-6-13(2)12-17(18)20(26)24(21)4/h6-12,14H,5H2,1-4H3,(H,22,25)