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

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C23H20ClN5O2S MolecularWeight: 465.9552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NN(C=C4Cl)CC5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NN(C=C4Cl)CC5=CC=CC=C5

InChI

InChI=1S/C23H20ClN5O2S/c24-18-13-28(12-15-6-2-1-3-7-15)27-21(18)26-20(30)14-32-23-25-19-9-5-4-8-17(19)22(31)29(23)16-10-11-16/h1-9,13,16H,10-12,14H2,(H,26,27,30)