8-(2-butoxy-5-morpholin-4-ylsulfonyl-phenyl)-6-diazanyl-3-propyl-7H-purin-2-one

Systemtic Name: 8-(2-butoxy-5-morpholin-4-ylsulfonyl-phenyl)-6-diazanyl-3-propyl-7H-purin-2-one Openeye Name: 8-(2-butoxy-5-morpholinosulfonyl-phenyl)-6-hydrazino-3-propyl-7H-purin-2-one CAS Name: 8-[2-butoxy-5-(4-morpholinylsulfonyl)phenyl]-6-hydrazinyl-3-propyl-7H-purin-2-one IUPAC Name: 8-(2-butoxy-5-morpholin-4-ylsulfonylphenyl)-6-hydrazinyl-3-propyl-7H-purin-2-one Traditional Name: 8-(2-butoxy-5-morpholinosulfonyl-phenyl)-6-hydrazino-3-propyl-7H-purin-2-one Formula: C22H31N7O5S MolecularWeight: 505.59044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=NC4=C(N3)C(=NC(=O)N4CCC)NN

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=NC4=C(N3)C(=NC(=O)N4CCC)NN

InChI

InChI=1S/C22H31N7O5S/c1-3-5-11-34-17-7-6-15(35(31,32)28-9-12-33-13-10-28)14-16(17)19-24-18-20(27-23)26-22(30)29(8-4-2)21(18)25-19/h6-7,14H,3-5,8-13,23H2,1-2H3,(H,24,25)(H,26,27,30)