8-(3-azanylpiperidin-1-yl)-1-(indol-1-ylmethyl)-3-methyl-7-(3-methylbut-2-enyl)-8,9-dihydropurine-2,6-dione

Systemtic Name: 8-(3-azanylpiperidin-1-yl)-1-(indol-1-ylmethyl)-3-methyl-7-(3-methylbut-2-enyl)-8,9-dihydropurine-2,6-dione Openeye Name: 8-(3-amino-1-piperidyl)-1-(indol-1-ylmethyl)-3-methyl-7-(3-methylbut-2-enyl)-8,9-dihydropurine-2,6-dione CAS Name: 8-(3-amino-1-piperidinyl)-1-(1-indolylmethyl)-3-methyl-7-(3-methylbut-2-enyl)-8,9-dihydropurine-2,6-dione IUPAC Name: 8-(3-aminopiperidin-1-yl)-1-(indol-1-ylmethyl)-3-methyl-7-(3-methylbut-2-enyl)-8,9-dihydropurine-2,6-dione Traditional Name: 8-(3-aminopiperidino)-1-(indol-1-ylmethyl)-3-methyl-7-(3-methylbut-2-enyl)-8,9-dihydropurine-2,6-quinone Formula: C25H33N7O2 MolecularWeight: 463.57522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C(NC2=C1C(=O)N(C(=O)N2C)CN3C=CC4=CC=CC=C43)N5CCCC(C5)N)C

Isomeric SMILES

CC(=CCN1C(NC2=C1C(=O)N(C(=O)N2C)CN3C=CC4=CC=CC=C43)N5CCCC(C5)N)C

InChI

InChI=1S/C25H33N7O2/c1-17(2)10-14-31-21-22(27-24(31)29-12-6-8-19(26)15-29)28(3)25(34)32(23(21)33)16-30-13-11-18-7-4-5-9-20(18)30/h4-5,7,9-11,13,19,24,27H,6,8,12,14-16,26H2,1-3H3