4-[(2-azanyl-3H-benzimidazol-5-yl)amino]-6-methyl-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-[(2-azanyl-3H-benzimidazol-5-yl)amino]-6-methyl-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-[(2-amino-3H-benzimidazol-5-yl)amino]-6-methyl-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile CAS Name: 4-[(2-amino-3H-benzimidazol-5-yl)amino]-6-methyl-7-[3-(1-pyrrolidinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-[(2-amino-3H-benzimidazol-5-yl)amino]-6-methyl-7-(3-pyrrolidin-1-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-[(2-amino-3H-benzimidazol-5-yl)amino]-6-methyl-7-(3-pyrrolidinopropoxy)quinoline-3-carbonitrile Formula: C25H27N7O MolecularWeight: 441.52818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)N=C(N4)N)OCCCN5CCCC5

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)N=C(N4)N)OCCCN5CCCC5

InChI

InChI=1S/C25H27N7O/c1-16-11-19-21(13-23(16)33-10-4-9-32-7-2-3-8-32)28-15-17(14-26)24(19)29-18-5-6-20-22(12-18)31-25(27)30-20/h5-6,11-13,15H,2-4,7-10H2,1H3,(H,28,29)(H3,27,30,31)