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

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-2-chloranyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-2-chloro-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-2-chloro-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-chloro-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-2-chloro-5-piperidinosulfonyl-benzamide Formula: C23H32ClN5O5S MolecularWeight: 526.04868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C23H32ClN5O5S/c1-3-5-14-28(19-20(25)29(11-4-2)23(32)26-21(19)30)22(31)17-15-16(9-10-18(17)24)35(33,34)27-12-7-6-8-13-27/h9-10,15H,3-8,11-14,25H2,1-2H3,(H,26,30,32)