8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-hexadecyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-hexadecyl-3-methyl-purine-2,6-dione Openeye Name: 8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazino]-7-hexadecyl-3-methyl-purine-2,6-dione CAS Name: 8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-hexadecyl-3-methylpurine-2,6-dione IUPAC Name: 8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-hexadecyl-3-methylpurine-2,6-dione Traditional Name: 7-cetyl-8-[(N'Z)-N'-[1-(4-chlorophenyl)ethylidene]hydrazino]-3-methyl-xanthine Formula: C30H45ClN6O2 MolecularWeight: 557.1703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(N=C1NN=C(C)C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(N=C1N/N=C(/C)\C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C

InChI

InChI=1S/C30H45ClN6O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-37-26-27(36(3)30(39)33-28(26)38)32-29(37)35-34-23(2)24-18-20-25(31)21-19-24/h18-21H,4-17,22H2,1-3H3,(H,32,35)(H,33,38,39)/b34-23-