4-azanyl-3-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-1-oxidanylidene-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-azanyl-3-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-1-oxidanylidene-1,2-thiazole-5-carboxylic acid Openeye Name: 4-amino-3-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethylamino]-1-oxo-isothiazole-5-carboxylic acid CAS Name: 4-amino-3-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethylamino]-1-oxo-5-isothiazolecarboxylic acid IUPAC Name: 4-amino-3-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-1-oxo-1,2-thiazole-5-carboxylic acid Traditional Name: 4-amino-3-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethylamino]-1-keto-isothiazole-5-carboxylic acid Formula: C14H20N4O4S2 MolecularWeight: 372.463

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(O1)CSCCNC2=NS(=O)C(=C2N)C(=O)O

Isomeric SMILES

CN(C)CC1=CC=C(O1)CSCCNC2=NS(=O)C(=C2N)C(=O)O

InChI

InChI=1S/C14H20N4O4S2/c1-18(2)7-9-3-4-10(22-9)8-23-6-5-16-13-11(15)12(14(19)20)24(21)17-13/h3-4H,5-8,15H2,1-2H3,(H,16,17)(H,19,20)