N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(furan-2-ylmethyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(furan-2-ylmethyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-(2-furylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(2-furanylmethyl)-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(furan-2-ylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-(2-furfuryl)-1-(2-thenoyl)nipecotamide Formula: C24H29N5O5S MolecularWeight: 499.58256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)C3CCCN(C3)C(=O)C4=CC=CS4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)C3CCCN(C3)C(=O)C4=CC=CS4)N

InChI

InChI=1S/C24H29N5O5S/c1-2-3-11-28-20(25)19(21(30)26-24(28)33)29(15-17-8-5-12-34-17)22(31)16-7-4-10-27(14-16)23(32)18-9-6-13-35-18/h5-6,8-9,12-13,16H,2-4,7,10-11,14-15,25H2,1H3,(H,26,30,33)