8-[2-butoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-6-diazanyl-3-propyl-7H-purin-2-one

Systemtic Name: 8-[2-butoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-6-diazanyl-3-propyl-7H-purin-2-one Openeye Name: 8-[2-butoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-6-hydrazino-3-propyl-7H-purin-2-one CAS Name: 8-[2-butoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-6-hydrazinyl-3-propyl-7H-purin-2-one IUPAC Name: 8-[2-butoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-6-hydrazinyl-3-propyl-7H-purin-2-one Traditional Name: 8-[2-butoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-6-hydrazino-3-propyl-7H-purin-2-one Formula: C23H34N8O4S MolecularWeight: 518.63226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C3=NC4=C(N3)C(=NC(=O)N4CCC)NN

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C3=NC4=C(N3)C(=NC(=O)N4CCC)NN

InChI

InChI=1S/C23H34N8O4S/c1-4-6-14-35-18-8-7-16(36(33,34)30-12-10-29(3)11-13-30)15-17(18)20-25-19-21(28-24)27-23(32)31(9-5-2)22(19)26-20/h7-8,15H,4-6,9-14,24H2,1-3H3,(H,25,26)(H,27,28,32)