N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-4-[[(2R)-2-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-ethyl-4-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-4-[(2R)-2-methylpiperidino]sulfonyl-benzamide Formula: C23H33N5O5S MolecularWeight: 491.60362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC[C@H]3C)N

InChI

InChI=1S/C23H33N5O5S/c1-4-6-14-27-20(24)19(21(29)25-23(27)31)26(5-2)22(30)17-10-12-18(13-11-17)34(32,33)28-15-8-7-9-16(28)3/h10-13,16H,4-9,14-15,24H2,1-3H3,(H,25,29,31)/t16-/m1/s1