N1'-[2-[(E)-2-(1H-indol-3-yl)ethenyl]-6-methyl-quinazolin-4-yl]dodecane-1,1-diamine

Systemtic Name: N1'-[2-[(E)-2-(1H-indol-3-yl)ethenyl]-6-methyl-quinazolin-4-yl]dodecane-1,1-diamine Openeye Name: N1'-[2-[(E)-2-(1H-indol-3-yl)vinyl]-6-methyl-quinazolin-4-yl]dodecane-1,1-diamine CAS Name: N1'-[2-[(E)-2-(1H-indol-3-yl)ethenyl]-6-methyl-4-quinazolinyl]dodecane-1,1-diamine IUPAC Name: 1-N'-[2-[(E)-2-(1H-indol-3-yl)ethenyl]-6-methylquinazolin-4-yl]dodecane-1,1-diamine Traditional Name: 1-aminododecyl-[2-[(E)-2-(1H-indol-3-yl)vinyl]-6-methyl-quinazolin-4-yl]amine Formula: C31H41N5 MolecularWeight: 483.69074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(N)NC1=NC(=NC2=C1C=C(C=C2)C)C=CC3=CNC4=CC=CC=C43

Isomeric SMILES

CCCCCCCCCCCC(N)NC1=NC(=NC2=C1C=C(C=C2)C)/C=C/C3=CNC4=CC=CC=C43

InChI

InChI=1S/C31H41N5/c1-3-4-5-6-7-8-9-10-11-16-29(32)35-31-26-21-23(2)17-19-28(26)34-30(36-31)20-18-24-22-33-27-15-13-12-14-25(24)27/h12-15,17-22,29,33H,3-11,16,32H2,1-2H3,(H,34,35,36)/b20-18+