4-azanyl-N5-(2,4-dimethoxyphenyl)-N5-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(2,4-dimethoxyphenyl)-N5-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(2,4-dimethoxyphenyl)-N5-[2-(isopentylamino)-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(2,4-dimethoxyphenyl)-N5-[2-(3-methylbutylamino)-2-oxoethyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(2,4-dimethoxyphenyl)-5-N-[2-(3-methylbutylamino)-2-oxoethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(2,4-dimethoxyphenyl)-N'-[2-(isoamylamino)-2-keto-ethyl]isothiazole-3,5-dicarboxamide Formula: C20H27N5O5S MolecularWeight: 449.52388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN(C1=C(C=C(C=C1)OC)OC)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CC(C)CCNC(=O)CN(C1=C(C=C(C=C1)OC)OC)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C20H27N5O5S/c1-11(2)7-8-23-15(26)10-25(13-6-5-12(29-3)9-14(13)30-4)20(28)18-16(21)17(19(22)27)24-31-18/h5-6,9,11H,7-8,10,21H2,1-4H3,(H2,22,27)(H,23,26)