(2R)-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanamide

Systemtic Name: (2R)-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanamide Openeye Name: (2R)-2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylpropanamide CAS Name: (2R)-2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)N

Isomeric SMILES

C[C@H](C(=O)N)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCC(C)C

InChI

InChI=1S/C16H20ClN3O2S/c1-9(2)6-7-20-15(22)12-5-4-11(17)8-13(12)19-16(20)23-10(3)14(18)21/h4-5,8-10H,6-7H2,1-3H3,(H2,18,21)/t10-/m1/s1