2-[2-[[4,5-bis(bromanyl)thiophen-2-yl]methylamino]propylamino]-1H-quinolin-4-one

Systemtic Name: 2-[2-[[4,5-bis(bromanyl)thiophen-2-yl]methylamino]propylamino]-1H-quinolin-4-one Openeye Name: 2-[2-[(4,5-dibromo-2-thienyl)methylamino]propylamino]-1H-quinolin-4-one CAS Name: 2-[2-[(4,5-dibromo-2-thiophenyl)methylamino]propylamino]-1H-quinolin-4-one IUPAC Name: 2-[2-[(4,5-dibromothiophen-2-yl)methylamino]propylamino]-1H-quinolin-4-one Traditional Name: 2-[2-[(4,5-dibromo-2-thienyl)methylamino]propylamino]-4-quinolone Formula: C17H17Br2N3OS MolecularWeight: 471.20938

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC(=O)C2=CC=CC=C2N1)NCC3=CC(=C(S3)Br)Br

Isomeric SMILES

CC(CNC1=CC(=O)C2=CC=CC=C2N1)NCC3=CC(=C(S3)Br)Br

InChI

InChI=1S/C17H17Br2N3OS/c1-10(20-9-11-6-13(18)17(19)24-11)8-21-16-7-15(23)12-4-2-3-5-14(12)22-16/h2-7,10,20H,8-9H2,1H3,(H2,21,22,23)