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

Systemtic Name: 4-azanyl-N5-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-N5-(3-morpholin-4-ylpropyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclohexylamino)-2-oxo-ethyl]-N5-(3-morpholinopropyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(cyclohexylamino)-2-oxoethyl]-N5-[3-(4-morpholinyl)propyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(cyclohexylamino)-2-oxoethyl]-5-N-(3-morpholin-4-ylpropyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclohexylamino)-2-keto-ethyl]-N'-(3-morpholinopropyl)isothiazole-3,5-dicarboxamide Formula: C20H32N6O4S MolecularWeight: 452.57088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN(CCCN2CCOCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

C1CCC(CC1)NC(=O)CN(CCCN2CCOCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C20H32N6O4S/c21-16-17(19(22)28)24-31-18(16)20(29)26(8-4-7-25-9-11-30-12-10-25)13-15(27)23-14-5-2-1-3-6-14/h14H,1-13,21H2,(H2,22,28)(H,23,27)