methyl (NZ)-N-(3-methyl-1,3-benzothiazol-2-ylidene)-N'-(2-oxidanyl-2-pyridin-3-yl-ethyl)carbamimidothioate

Systemtic Name: methyl (NZ)-N-(3-methyl-1,3-benzothiazol-2-ylidene)-N'-(2-oxidanyl-2-pyridin-3-yl-ethyl)carbamimidothioate Openeye Name: (1Z)-3-[2-hydroxy-2-(3-pyridyl)ethyl]-2-methyl-1-(3-methyl-1,3-benzothiazol-2-ylidene)isothiourea CAS Name: (NZ)-N'-[2-hydroxy-2-(3-pyridinyl)ethyl]-N-(3-methyl-1,3-benzothiazol-2-ylidene)carbamimidothioic acid methyl ester IUPAC Name: methyl (NZ)-N'-(2-hydroxy-2-pyridin-3-ylethyl)-N-(3-methyl-1,3-benzothiazol-2-ylidene)carbamimidothioate Traditional Name: (1Z)-3-[2-hydroxy-2-(3-pyridyl)ethyl]-2-methyl-1-(3-methyl-1,3-benzothiazol-2-ylidene)isothiourea Formula: C17H18N4OS2 MolecularWeight: 358.48102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=NC(=NCC(C3=CN=CC=C3)O)SC

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=N\C(=NCC(C3=CN=CC=C3)O)SC

InChI

InChI=1S/C17H18N4OS2/c1-21-13-7-3-4-8-15(13)24-17(21)20-16(23-2)19-11-14(22)12-6-5-9-18-10-12/h3-10,14,22H,11H2,1-2H3/b19-16?,20-17-