1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-ethoxyphenyl)-1,2-diethyl-guanidine

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-ethoxyphenyl)-1,2-diethyl-guanidine Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-ethoxyphenyl)-1,2-diethyl-guanidine CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-ethoxyphenyl)-1,2-diethylguanidine IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-ethoxyphenyl)-1,2-diethylguanidine Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-1,2-diethyl-3-p-phenetyl-guanidine Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC1=CC=C(C=C1)OCC)N(CC)C2=NC3=C(S2)C=C(C=C3)OCC

Isomeric SMILES

CCN=C(NC1=CC=C(C=C1)OCC)N(CC)C2=NC3=C(S2)C=C(C=C3)OCC

InChI

InChI=1S/C22H28N4O2S/c1-5-23-21(24-16-9-11-17(12-10-16)27-7-3)26(6-2)22-25-19-14-13-18(28-8-4)15-20(19)29-22/h9-15H,5-8H2,1-4H3,(H,23,24)