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

Systemtic Name: methyl (NZ)-N-(3-methyl-1,3-benzothiazol-2-ylidene)-N'-(2-oxidanyl-2-phenyl-ethyl)carbamimidothioate Openeye Name: (1Z)-3-(2-hydroxy-2-phenyl-ethyl)-2-methyl-1-(3-methyl-1,3-benzothiazol-2-ylidene)isothiourea CAS Name: (NZ)-N'-(2-hydroxy-2-phenylethyl)-N-(3-methyl-1,3-benzothiazol-2-ylidene)carbamimidothioic acid methyl ester IUPAC Name: methyl (NZ)-N'-(2-hydroxy-2-phenylethyl)-N-(3-methyl-1,3-benzothiazol-2-ylidene)carbamimidothioate Traditional Name: (1Z)-3-(2-hydroxy-2-phenyl-ethyl)-2-methyl-1-(3-methyl-1,3-benzothiazol-2-ylidene)isothiourea Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3OS2/c1-21-14-10-6-7-11-16(14)24-18(21)20-17(23-2)19-12-15(22)13-8-4-3-5-9-13/h3-11,15,22H,12H2,1-2H3/b19-17?,20-18-