N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-chloranyl-N-(2-methylpropyl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-chloranyl-N-(2-methylpropyl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-chloro-N-isobutyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-chloro-N-(2-methylpropyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-chloro-N-(2-methylpropyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-chloro-N-isobutyl-5-piperidinosulfonyl-benzamide Formula: C24H34ClN5O5S MolecularWeight: 540.07526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)N

InChI

InChI=1S/C24H34ClN5O5S/c1-4-5-13-29-21(26)20(22(31)27-24(29)33)30(15-16(2)3)23(32)18-14-17(9-10-19(18)25)36(34,35)28-11-7-6-8-12-28/h9-10,14,16H,4-8,11-13,15,26H2,1-3H3,(H,27,31,33)