N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)piperidine-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)piperidine-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)-4-piperidinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-(4-methylphenyl)sulfonyl-N-(2-methylpropyl)piperidine-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-1-tosyl-isonipecotamide Formula: C25H37N5O5S MolecularWeight: 519.65678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)N

InChI

InChI=1S/C25H37N5O5S/c1-5-6-13-29-22(26)21(23(31)27-25(29)33)30(16-17(2)3)24(32)19-11-14-28(15-12-19)36(34,35)20-9-7-18(4)8-10-20/h7-10,17,19H,5-6,11-16,26H2,1-4H3,(H,27,31,33)