N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-4-[methyl(tosyl)amino]benzamide Formula: C27H35N5O5S MolecularWeight: 541.6623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C)N

InChI

InChI=1S/C27H35N5O5S/c1-5-7-17-31(23-24(28)32(18-8-6-2)27(35)29-25(23)33)26(34)20-11-13-21(14-12-20)30(4)38(36,37)22-15-9-19(3)10-16-22/h9-16H,5-8,17-18,28H2,1-4H3,(H,29,33,35)