4-[(3-bromophenyl)amino]-2-[4-[methyl(prop-2-enyl)amino]butyl]quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-2-[4-[methyl(prop-2-enyl)amino]butyl]quinoline-3-carbonitrile Openeye Name: 2-[4-[allyl(methyl)amino]butyl]-4-(3-bromoanilino)quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-2-[4-[methyl(prop-2-enyl)amino]butyl]-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-2-[4-[methyl(prop-2-enyl)amino]butyl]quinoline-3-carbonitrile Traditional Name: 2-[4-[allyl(methyl)amino]butyl]-4-(3-bromoanilino)quinoline-3-carbonitrile Formula: C24H25BrN4 MolecularWeight: 449.3861

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC1=NC2=CC=CC=C2C(=C1C#N)NC3=CC(=CC=C3)Br)CC=C

Isomeric SMILES

CN(CCCCC1=NC2=CC=CC=C2C(=C1C#N)NC3=CC(=CC=C3)Br)CC=C

InChI

InChI=1S/C24H25BrN4/c1-3-14-29(2)15-7-6-13-23-21(17-26)24(20-11-4-5-12-22(20)28-23)27-19-10-8-9-18(25)16-19/h3-5,8-12,16H,1,6-7,13-15H2,2H3,(H,27,28)