2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]ethanamide Openeye Name: 2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide Traditional Name: 2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide Formula: C21H26ClN5O2S MolecularWeight: 447.98144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C(C)C)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C(C)C)C

InChI

InChI=1S/C21H26ClN5O2S/c1-13(2)27-20(29)17-7-6-16(22)11-18(17)24-21(27)30-12-19(28)23-8-5-9-26-15(4)10-14(3)25-26/h6-7,10-11,13H,5,8-9,12H2,1-4H3,(H,23,28)