7-hexadecyl-3-methyl-8-[(2Z)-2-(1-phenylbutylidene)hydrazinyl]-4,5-dihydropurine-2,6-dione

Systemtic Name: 7-hexadecyl-3-methyl-8-[(2Z)-2-(1-phenylbutylidene)hydrazinyl]-4,5-dihydropurine-2,6-dione Openeye Name: 7-hexadecyl-3-methyl-8-[(2Z)-2-(1-phenylbutylidene)hydrazino]-4,5-dihydropurine-2,6-dione CAS Name: 7-hexadecyl-3-methyl-8-[(2Z)-2-(1-phenylbutylidene)hydrazinyl]-4,5-dihydropurine-2,6-dione IUPAC Name: 7-hexadecyl-3-methyl-8-[(2Z)-2-(1-phenylbutylidene)hydrazinyl]-4,5-dihydropurine-2,6-dione Traditional Name: 7-cetyl-3-methyl-8-[(N'Z)-N'-(1-phenylbutylidene)hydrazino]-4,5-dihydropurine-2,6-quinone Formula: C32H52N6O2 MolecularWeight: 552.79428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2C(N=C1NN=C(CCC)C3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2C(N=C1N/N=C(/CCC)\C3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C32H52N6O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21-25-38-28-29(37(3)32(40)34-30(28)39)33-31(38)36-35-27(22-5-2)26-23-19-18-20-24-26/h18-20,23-24,28-29H,4-17,21-22,25H2,1-3H3,(H,33,36)(H,34,39,40)/b35-27-