N-cyclopropyl-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-cyclopropyl-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-cyclopropyl-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-cyclopropyl-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-cyclopropyl-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-cyclopropyl-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3CC3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3CC3

InChI

InChI=1S/C20H27N3O2S/c1-3-4-5-8-13-23-19(25)16-9-6-7-10-17(16)22-20(23)26-14(2)18(24)21-15-11-12-15/h6-7,9-10,14-15H,3-5,8,11-13H2,1-2H3,(H,21,24)