2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide

Systemtic Name: 2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide Openeye Name: 2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-amino]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide CAS Name: 2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]-N-[oxo-(2-thiophen-2-ylethylamino)methyl]acetamide IUPAC Name: 2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylamino]-N-(2-thiophen-2-ylethylcarbamoyl)acetamide Traditional Name: 2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-amino]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide Formula: C22H34N6O4S MolecularWeight: 478.60816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC(=O)NCCC1=CC=CS1)C2=C(N(C(=O)NC2=O)CCCC)N

Isomeric SMILES

CCCCCN(CC(=O)NC(=O)NCCC1=CC=CS1)C2=C(N(C(=O)NC2=O)CCCC)N

InChI

InChI=1S/C22H34N6O4S/c1-3-5-7-12-27(18-19(23)28(13-6-4-2)22(32)26-20(18)30)15-17(29)25-21(31)24-11-10-16-9-8-14-33-16/h8-9,14H,3-7,10-13,15,23H2,1-2H3,(H,26,30,32)(H2,24,25,29,31)