4-azanyl-N5-tert-butyl-N5-[1-(3-methylbutylamino)-1-oxidanylidene-butan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-tert-butyl-N5-[1-(3-methylbutylamino)-1-oxidanylidene-butan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-tert-butyl-N5-[1-(isopentylcarbamoyl)propyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-tert-butyl-N5-[1-(3-methylbutylamino)-1-oxobutan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-tert-butyl-5-N-[1-(3-methylbutylamino)-1-oxobutan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-tert-butyl-N'-[1-(isoamylcarbamoyl)propyl]isothiazole-3,5-dicarboxamide Formula: C18H31N5O3S MolecularWeight: 397.53544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCC(C)C)N(C(=O)C1=C(C(=NS1)C(=O)N)N)C(C)(C)C

Isomeric SMILES

CCC(C(=O)NCCC(C)C)N(C(=O)C1=C(C(=NS1)C(=O)N)N)C(C)(C)C

InChI

InChI=1S/C18H31N5O3S/c1-7-11(16(25)21-9-8-10(2)3)23(18(4,5)6)17(26)14-12(19)13(15(20)24)22-27-14/h10-11H,7-9,19H2,1-6H3,(H2,20,24)(H,21,25)