1,3-benzothiazol-2-ylmethyl 3-phenothiazin-10-ylpropanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-phenothiazin-10-ylpropanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C23H18N2O2S2 MolecularWeight: 418.53122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C23H18N2O2S2/c26-23(27-15-22-24-16-7-1-4-10-19(16)29-22)13-14-25-17-8-2-5-11-20(17)28-21-12-6-3-9-18(21)25/h1-12H,13-15H2