2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide Openeye Name: 2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide CAS Name: 2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-N-(3-methoxyphenyl)butanamide IUPAC Name: 2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide Traditional Name: 2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(3-methoxyphenyl)butyramide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=CC=CC=C3C(=O)N2CC

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=CC=CC=C3C(=O)N2CC

InChI

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