5-methylsulfanyl-N'-[2-[(4-phenylmethoxyphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboximidamide

Systemtic Name: 5-methylsulfanyl-N'-[2-[(4-phenylmethoxyphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboximidamide Openeye Name: N'-[2-(4-benzyloxyanilino)thiazol-4-yl]-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 5-(methylthio)-N'-[2-(4-phenylmethoxyanilino)-4-thiazolyl]-2-thiophenecarboximidamide IUPAC Name: 5-methylsulfanyl-N'-[2-(4-phenylmethoxyanilino)-1,3-thiazol-4-yl]thiophene-2-carboximidamide Traditional Name: N'-[2-(4-benzoxyanilino)thiazol-4-yl]-5-(methylthio)thiophene-2-carboxamidine Formula: C22H20N4OS3 MolecularWeight: 452.6154

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(S1)C(=NC2=CSC(=N2)NC3=CC=C(C=C3)OCC4=CC=CC=C4)N

Isomeric SMILES

CSC1=CC=C(S1)/C(=N\C2=CSC(=N2)NC3=CC=C(C=C3)OCC4=CC=CC=C4)/N

InChI

InChI=1S/C22H20N4OS3/c1-28-20-12-11-18(30-20)21(23)25-19-14-29-22(26-19)24-16-7-9-17(10-8-16)27-13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3,(H2,23,25)(H,24,26)