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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-1-(4-isopropylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(2-methylpropyl)-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(2-methylpropyl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-1-p-cumenylsulfonyl-isonipecotamide Formula: C27H41N5O5S MolecularWeight: 547.70994

Click to see the large picture

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(C)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(C)C)N

InChI

InChI=1S/C27H41N5O5S/c1-6-7-14-31-24(28)23(25(33)29-27(31)35)32(17-18(2)3)26(34)21-12-15-30(16-13-21)38(36,37)22-10-8-20(9-11-22)19(4)5/h8-11,18-19,21H,6-7,12-17,28H2,1-5H3,(H,29,33,35)