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

Systemtic Name: 2-[3-[(4-bromanyl-5-methyl-thiophen-2-yl)methylamino]propylamino]-1H-quinolin-4-one Openeye Name: 2-[3-[(4-bromo-5-methyl-2-thienyl)methylamino]propylamino]-1H-quinolin-4-one CAS Name: 2-[3-[(4-bromo-5-methyl-2-thiophenyl)methylamino]propylamino]-1H-quinolin-4-one IUPAC Name: 2-[3-[(4-bromo-5-methylthiophen-2-yl)methylamino]propylamino]-1H-quinolin-4-one Traditional Name: 2-[3-[(4-bromo-5-methyl-2-thienyl)methylamino]propylamino]-4-quinolone Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)CNCCCNC2=CC(=O)C3=CC=CC=C3N2)Br

Isomeric SMILES

CC1=C(C=C(S1)CNCCCNC2=CC(=O)C3=CC=CC=C3N2)Br

InChI

InChI=1S/C18H20BrN3OS/c1-12-15(19)9-13(24-12)11-20-7-4-8-21-18-10-17(23)14-5-2-3-6-16(14)22-18/h2-3,5-6,9-10,20H,4,7-8,11H2,1H3,(H2,21,22,23)