2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-1-(1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: 2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-1-(1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-1-(1H-indol-3-yl)-2-phenyl-ethanone CAS Name: 2-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-1-(1H-indol-3-yl)-2-phenylethanone IUPAC Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-1-(1H-indol-3-yl)-2-phenylethanone Traditional Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-1-(1H-indol-3-yl)-2-phenyl-ethanone Formula: C29H28N6O MolecularWeight: 476.57222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(C4=CC=CC=C4)C(=O)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(C4=CC=CC=C4)C(=O)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C29H28N6O/c30-29-22-11-5-7-13-25(22)32-26(33-29)19-34-14-16-35(17-15-34)27(20-8-2-1-3-9-20)28(36)23-18-31-24-12-6-4-10-21(23)24/h1-13,18,27,31H,14-17,19H2,(H2,30,32,33)