N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-methyl-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-methyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-methyl-1-(2-thienylsulfonyl)isonipecotamide Formula: C19H27N5O5S2 MolecularWeight: 469.57818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)N

InChI

InChI=1S/C19H27N5O5S2/c1-3-4-9-24-16(20)15(17(25)21-19(24)27)22(2)18(26)13-7-10-23(11-8-13)31(28,29)14-6-5-12-30-14/h5-6,12-13H,3-4,7-11,20H2,1-2H3,(H,21,25,27)