N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-2,2-bis(sulfanyl)propanamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-2,2-bis(sulfanyl)propanamide Openeye Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-2,2-bis(sulfanyl)propanamide CAS Name: N-[4-(3-bromoanilino)-6-quinazolinyl]-2,2-dimercaptopropanamide IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-2,2-bis(sulfanyl)propanamide Traditional Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-2,2-dimercapto-propionamide Formula: C17H15BrN4OS2 MolecularWeight: 435.3612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN4OS2/c1-17(24,25)16(23)22-12-5-6-14-13(8-12)15(20-9-19-14)21-11-4-2-3-10(18)7-11/h2-9,24-25H,1H3,(H,22,23)(H,19,20,21)