4-azanyl-N5-[(2S)-1-(tert-butylamino)-1-oxidanylidene-hexan-2-yl]-N5-cyclohexyl-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(2S)-1-(tert-butylamino)-1-oxidanylidene-hexan-2-yl]-N5-cyclohexyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-1-(tert-butylcarbamoyl)pentyl]-N5-cyclohexyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2S)-1-(tert-butylamino)-1-oxohexan-2-yl]-N5-cyclohexylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2S)-1-(tert-butylamino)-1-oxohexan-2-yl]-5-N-cyclohexyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-1-(tert-butylcarbamoyl)pentyl]-N'-cyclohexyl-isothiazole-3,5-dicarboxamide Formula: C21H35N5O3S MolecularWeight: 437.5993

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(C)(C)C)N(C1CCCCC1)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CCCC[C@@H](C(=O)NC(C)(C)C)N(C1CCCCC1)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C21H35N5O3S/c1-5-6-12-14(19(28)24-21(2,3)4)26(13-10-8-7-9-11-13)20(29)17-15(22)16(18(23)27)25-30-17/h13-14H,5-12,22H2,1-4H3,(H2,23,27)(H,24,28)/t14-/m0/s1