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

Systemtic Name: 4-azanyl-N5-[2-(tert-butylamino)-1-(furan-2-yl)-2-oxidanylidene-ethyl]-N5-cyclohexyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(tert-butylamino)-1-(2-furyl)-2-oxo-ethyl]-N5-cyclohexyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(tert-butylamino)-1-(2-furanyl)-2-oxoethyl]-N5-cyclohexylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(tert-butylamino)-1-(furan-2-yl)-2-oxoethyl]-5-N-cyclohexyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-butylamino)-1-(2-furyl)-2-keto-ethyl]-N'-cyclohexyl-isothiazole-3,5-dicarboxamide Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CO1)N(C2CCCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=CO1)N(C2CCCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C21H29N5O4S/c1-21(2,3)24-19(28)16(13-10-7-11-30-13)26(12-8-5-4-6-9-12)20(29)17-14(22)15(18(23)27)25-31-17/h7,10-12,16H,4-6,8-9,22H2,1-3H3,(H2,23,27)(H,24,28)