methyl N-(4-chloranyl-1H-indazol-5-yl)-N'-(2-hydroxyethyl)carbamimidothioate

Systemtic Name: methyl N-(4-chloranyl-1H-indazol-5-yl)-N'-(2-hydroxyethyl)carbamimidothioate Openeye Name: 1-(4-chloro-1H-indazol-5-yl)-3-(2-hydroxyethyl)-2-methyl-isothiourea CAS Name: N-(4-chloro-1H-indazol-5-yl)-N'-(2-hydroxyethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-chloro-1H-indazol-5-yl)-N'-(2-hydroxyethyl)carbamimidothioate Traditional Name: 1-(4-chloro-1H-indazol-5-yl)-3-(2-hydroxyethyl)-2-methyl-isothiourea Formula: C11H13ClN4OS MolecularWeight: 284.76512

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCO)NC1=C(C2=C(C=C1)NN=C2)Cl

Isomeric SMILES

CSC(=NCCO)NC1=C(C2=C(C=C1)NN=C2)Cl

InChI

InChI=1S/C11H13ClN4OS/c1-18-11(13-4-5-17)15-9-3-2-8-7(10(9)12)6-14-16-8/h2-3,6,17H,4-5H2,1H3,(H,13,15)(H,14,16)