4-azanyl-N5-[2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N5-(oxolan-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N5-(oxolan-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-N5-(tetrahydrofuran-2-ylmethyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-N5-(2-oxolanylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-5-N-(oxolan-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl]-N'-(tetrahydrofurfuryl)isothiazole-3,5-dicarboxamide Formula: C22H28N6O4S MolecularWeight: 472.56052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=NC=C2)N(CC3CCCO3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC=NC=C2)N(CC3CCCO3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C22H28N6O4S/c23-16-17(20(24)29)27-33-19(16)22(31)28(12-15-6-3-11-32-15)18(13-7-9-25-10-8-13)21(30)26-14-4-1-2-5-14/h7-10,14-15,18H,1-6,11-12,23H2,(H2,24,29)(H,26,30)