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

Systemtic Name: 4-azanyl-N5-[2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N5-(3-morpholin-4-ylpropyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-N5-(3-morpholinopropyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-N5-[3-(4-morpholinyl)propyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-5-N-(3-morpholin-4-ylpropyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl]-N'-(3-morpholinopropyl)isothiazole-3,5-dicarboxamide Formula: C24H33N7O4S MolecularWeight: 515.62832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=NC=C2)N(CCCN3CCOCC3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC=NC=C2)N(CCCN3CCOCC3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C24H33N7O4S/c25-18-19(22(26)32)29-36-21(18)24(34)31(11-3-10-30-12-14-35-15-13-30)20(16-6-8-27-9-7-16)23(33)28-17-4-1-2-5-17/h6-9,17,20H,1-5,10-15,25H2,(H2,26,32)(H,28,33)