N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N,4-dimethyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N,4-dimethyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N,4-dimethyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N,4-dimethyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N,4-dimethyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N,4-dimethyl-3-piperidinosulfonyl-benzamide Formula: C22H31N5O5S MolecularWeight: 477.57704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N5O5S/c1-4-5-13-27-19(23)18(20(28)24-22(27)30)25(3)21(29)16-10-9-15(2)17(14-16)33(31,32)26-11-7-6-8-12-26/h9-10,14H,4-8,11-13,23H2,1-3H3,(H,24,28,30)