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

Systemtic Name: N-[4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-amino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylamino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-amino]-4-keto-butyl]thiophene-2-carboxamide Formula: C22H33N5O4S MolecularWeight: 463.59352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)CCCNC(=O)C2=CC=CS2

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)CCCNC(=O)C2=CC=CS2

InChI

InChI=1S/C22H33N5O4S/c1-3-5-7-14-26(17(28)11-8-12-24-20(29)16-10-9-15-32-16)18-19(23)27(13-6-4-2)22(31)25-21(18)30/h9-10,15H,3-8,11-14,23H2,1-2H3,(H,24,29)(H,25,30,31)