2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide

Systemtic Name: 2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide Openeye Name: 2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-methylisoxazol-5-yl)propanamide CAS Name: 2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methyl-5-isoxazolyl)propanamide IUPAC Name: 2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide Traditional Name: 2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-(3-methylisoxazol-5-yl)propionamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCC(C)C

Isomeric SMILES

CC1=NOC(=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCC(C)C

InChI

InChI=1S/C20H24N4O3S/c1-12(2)9-10-24-19(26)15-7-5-6-8-16(15)21-20(24)28-14(4)18(25)22-17-11-13(3)23-27-17/h5-8,11-12,14H,9-10H2,1-4H3,(H,22,25)