N-[4-(1,3-benzothiazol-2-yl)-2-fluoranyl-phenyl]-7-chloranyl-quinazolin-4-amine

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-2-fluoranyl-phenyl]-7-chloranyl-quinazolin-4-amine Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-2-fluoro-phenyl]-7-chloro-quinazolin-4-amine CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-fluorophenyl]-7-chloro-4-quinazolinamine IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-2-fluorophenyl]-7-chloroquinazolin-4-amine Traditional Name: [4-(1,3-benzothiazol-2-yl)-2-fluoro-phenyl]-(7-chloroquinazolin-4-yl)amine Formula: C21H12ClFN4S MolecularWeight: 406.863183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)NC4=NC=NC5=C4C=CC(=C5)Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)NC4=NC=NC5=C4C=CC(=C5)Cl)F

InChI

InChI=1S/C21H12ClFN4S/c22-13-6-7-14-18(10-13)24-11-25-20(14)26-16-8-5-12(9-15(16)23)21-27-17-3-1-2-4-19(17)28-21/h1-11H,(H,24,25,26)