2-[3-[3-(4-chloranyl-3-methyl-pyrazol-1-yl)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-propyl-ethanamide

Systemtic Name: 2-[3-[3-(4-chloranyl-3-methyl-pyrazol-1-yl)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[3-[3-(4-chloro-3-methyl-pyrazol-1-yl)propyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[3-[3-(4-chloro-3-methyl-1-pyrazolyl)propyl]-4-oxo-2-quinazolinyl]thio]-N-propylacetamide IUPAC Name: 2-[3-[3-(4-chloro-3-methylpyrazol-1-yl)propyl]-4-oxoquinazolin-2-yl]sulfanyl-N-propylacetamide Traditional Name: 2-[[3-[3-(4-chloro-3-methyl-pyrazol-1-yl)propyl]-4-keto-quinazolin-2-yl]thio]-N-propyl-acetamide Formula: C20H24ClN5O2S MolecularWeight: 433.95486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCN3C=C(C(=N3)C)Cl

Isomeric SMILES

CCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCN3C=C(C(=N3)C)Cl

InChI

InChI=1S/C20H24ClN5O2S/c1-3-9-22-18(27)13-29-20-23-17-8-5-4-7-15(17)19(28)26(20)11-6-10-25-12-16(21)14(2)24-25/h4-5,7-8,12H,3,6,9-11,13H2,1-2H3,(H,22,27)