(2R)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2R)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2R)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(isopropylcarbamoyl)propanamide CAS Name: (2R)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2R)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2R)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(isopropylcarbamoyl)propionamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC(C)C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

InChI

InChI=1S/C20H26N4O3S/c1-12(2)21-19(27)23-17(25)13(3)28-20-22-16-11-7-6-10-15(16)18(26)24(20)14-8-4-5-9-14/h6-7,10-14H,4-5,8-9H2,1-3H3,(H2,21,23,25,27)/t13-/m1/s1