2-[4-[(2-chlorophenyl)amino]quinazolin-2-yl]sulfanyl-N-propan-2-yl-propanamide

Systemtic Name: 2-[4-[(2-chlorophenyl)amino]quinazolin-2-yl]sulfanyl-N-propan-2-yl-propanamide Openeye Name: 2-[4-(2-chloroanilino)quinazolin-2-yl]sulfanyl-N-isopropyl-propanamide CAS Name: 2-[[4-(2-chloroanilino)-2-quinazolinyl]thio]-N-propan-2-ylpropanamide IUPAC Name: 2-[4-(2-chloroanilino)quinazolin-2-yl]sulfanyl-N-propan-2-ylpropanamide Traditional Name: 2-[[4-(2-chloroanilino)quinazolin-2-yl]thio]-N-isopropyl-propionamide Formula: C20H21ClN4OS MolecularWeight: 400.92494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4OS/c1-12(2)22-19(26)13(3)27-20-24-16-10-6-4-8-14(16)18(25-20)23-17-11-7-5-9-15(17)21/h4-13H,1-3H3,(H,22,26)(H,23,24,25)