6-(1-methylindol-3-yl)-8-phenethyl-2-piperazin-1-yl-pteridin-7-one

Systemtic Name: 6-(1-methylindol-3-yl)-8-phenethyl-2-piperazin-1-yl-pteridin-7-one Openeye Name: 6-(1-methylindol-3-yl)-8-phenethyl-2-piperazin-1-yl-pteridin-7-one CAS Name: 6-(1-methyl-3-indolyl)-8-phenethyl-2-(1-piperazinyl)-7-pteridinone IUPAC Name: 6-(1-methylindol-3-yl)-8-phenethyl-2-piperazin-1-ylpteridin-7-one Traditional Name: 6-(1-methylindol-3-yl)-8-phenethyl-2-piperazino-pteridin-7-one Formula: C27H27N7O MolecularWeight: 465.54958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=NC4=CN=C(N=C4N(C3=O)CCC5=CC=CC=C5)N6CCNCC6

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=NC4=CN=C(N=C4N(C3=O)CCC5=CC=CC=C5)N6CCNCC6

InChI

InChI=1S/C27H27N7O/c1-32-18-21(20-9-5-6-10-23(20)32)24-26(35)34(14-11-19-7-3-2-4-8-19)25-22(30-24)17-29-27(31-25)33-15-12-28-13-16-33/h2-10,17-18,28H,11-16H2,1H3