2-[3-[[4,5-bis(bromanyl)-3-methyl-thiophen-2-yl]methylamino]propylamino]-1H-quinolin-4-one

Systemtic Name: 2-[3-[[4,5-bis(bromanyl)-3-methyl-thiophen-2-yl]methylamino]propylamino]-1H-quinolin-4-one Openeye Name: 2-[3-[(4,5-dibromo-3-methyl-2-thienyl)methylamino]propylamino]-1H-quinolin-4-one CAS Name: 2-[3-[(4,5-dibromo-3-methyl-2-thiophenyl)methylamino]propylamino]-1H-quinolin-4-one IUPAC Name: 2-[3-[(4,5-dibromo-3-methylthiophen-2-yl)methylamino]propylamino]-1H-quinolin-4-one Traditional Name: 2-[3-[(4,5-dibromo-3-methyl-2-thienyl)methylamino]propylamino]-4-quinolone Formula: C18H19Br2N3OS MolecularWeight: 485.23596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1Br)Br)CNCCCNC2=CC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(SC(=C1Br)Br)CNCCCNC2=CC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H19Br2N3OS/c1-11-15(25-18(20)17(11)19)10-21-7-4-8-22-16-9-14(24)12-5-2-3-6-13(12)23-16/h2-3,5-6,9,21H,4,7-8,10H2,1H3,(H2,22,23,24)