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

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide Openeye Name: 2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-(3-methoxyphenyl)butanamide IUPAC Name: 2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)butanamide Traditional Name: 2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-(3-methoxyphenyl)butyramide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C22H23N3O3S/c1-3-19(20(26)23-14-7-6-8-16(13-14)28-2)29-22-24-18-10-5-4-9-17(18)21(27)25(22)15-11-12-15/h4-10,13,15,19H,3,11-12H2,1-2H3,(H,23,26)