2-(4-hydroxyphenyl)-2-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]ethanoic acid

Systemtic Name: 2-(4-hydroxyphenyl)-2-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]ethanoic acid Openeye Name: 2-(5-benzyl-6-thioxo-1,3,5-thiadiazinan-3-yl)-2-(4-hydroxyphenyl)acetic acid CAS Name: 2-(4-hydroxyphenyl)-2-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]acetic acid IUPAC Name: 2-(5-benzyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)-2-(4-hydroxyphenyl)acetic acid Traditional Name: 2-(5-benzyl-6-thioxo-1,3,5-thiadiazinan-3-yl)-2-(4-hydroxyphenyl)acetic acid Formula: C18H18N2O3S2 MolecularWeight: 374.47712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1CC2=CC=CC=C2)C(C3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

C1N(CSC(=S)N1CC2=CC=CC=C2)C(C3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C18H18N2O3S2/c21-15-8-6-14(7-9-15)16(17(22)23)20-11-19(18(24)25-12-20)10-13-4-2-1-3-5-13/h1-9,16,21H,10-12H2,(H,22,23)