N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-4-methylsulfanyl-butanamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-4-methylsulfanyl-butanamide Openeye Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-4-methylsulfanyl-butanamide CAS Name: N-[4-(3-bromoanilino)-6-quinazolinyl]-4-(methylthio)butanamide IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-4-methylsulfanylbutanamide Traditional Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-4-(methylthio)butyramide Formula: C19H19BrN4OS MolecularWeight: 431.34936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN4OS/c1-26-9-3-6-18(25)23-15-7-8-17-16(11-15)19(22-12-21-17)24-14-5-2-4-13(20)10-14/h2,4-5,7-8,10-12H,3,6,9H2,1H3,(H,23,25)(H,21,22,24)