(2R)-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2R)-2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(isopropylcarbamoyl)propanamide CAS Name: (2R)-2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2R)-2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2R)-2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-(isopropylcarbamoyl)propionamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)NC(C)C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC(C)C)SC1=NC2=CC=CC=C2C(=O)N1CCC(C)C

InChI

InChI=1S/C20H28N4O3S/c1-12(2)10-11-24-18(26)15-8-6-7-9-16(15)22-20(24)28-14(5)17(25)23-19(27)21-13(3)4/h6-9,12-14H,10-11H2,1-5H3,(H2,21,23,25,27)/t14-/m1/s1