N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-3-methylsulfonyl-propanamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-3-methylsulfonyl-propanamide Openeye Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-3-methylsulfonyl-propanamide CAS Name: N-[4-(3-bromoanilino)-6-quinazolinyl]-3-methylsulfonylpropanamide IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-3-methylsulfonylpropanamide Traditional Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-3-mesyl-propionamide Formula: C18H17BrN4O3S MolecularWeight: 449.32158

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

Isomeric SMILES

CS(=O)(=O)CCC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H17BrN4O3S/c1-27(25,26)8-7-17(24)22-14-5-6-16-15(10-14)18(21-11-20-16)23-13-4-2-3-12(19)9-13/h2-6,9-11H,7-8H2,1H3,(H,22,24)(H,20,21,23)