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

Systemtic Name: 4-azanyl-N5-(2-fluorophenyl)-N5-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(2-fluorophenyl)-N5-[2-(isopentylamino)-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(2-fluorophenyl)-N5-[2-(3-methylbutylamino)-2-oxoethyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(2-fluorophenyl)-5-N-[2-(3-methylbutylamino)-2-oxoethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(2-fluorophenyl)-N'-[2-(isoamylamino)-2-keto-ethyl]isothiazole-3,5-dicarboxamide Formula: C18H22FN5O3S MolecularWeight: 407.462383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN(C1=CC=CC=C1F)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CC(C)CCNC(=O)CN(C1=CC=CC=C1F)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C18H22FN5O3S/c1-10(2)7-8-22-13(25)9-24(12-6-4-3-5-11(12)19)18(27)16-14(20)15(17(21)26)23-28-16/h3-6,10H,7-9,20H2,1-2H3,(H2,21,26)(H,22,25)