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

Systemtic Name: N-cyclopentyl-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-cyclopentyl-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-cyclopentyl-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-cyclopentyl-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-cyclopentyl-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3CCCC3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3CCCC3

InChI

InChI=1S/C22H31N3O2S/c1-3-4-5-10-15-25-21(27)18-13-8-9-14-19(18)24-22(25)28-16(2)20(26)23-17-11-6-7-12-17/h8-9,13-14,16-17H,3-7,10-12,15H2,1-2H3,(H,23,26)