2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[5-(4-methylphenyl)-2-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[2-phenyl-5-(p-tolyl)pyrazol-3-yl]acetamide Formula: C29H26ClN5O2S MolecularWeight: 544.06704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C(C)C)C5=CC=CC=C5

InChI

InChI=1S/C29H26ClN5O2S/c1-18(2)34-28(37)23-14-13-21(30)15-25(23)31-29(34)38-17-27(36)32-26-16-24(20-11-9-19(3)10-12-20)33-35(26)22-7-5-4-6-8-22/h4-16,18H,17H2,1-3H3,(H,32,36)