2-[6-(4-phenylmethoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]guanidine

Systemtic Name: 2-[6-(4-phenylmethoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]guanidine Openeye Name: 2-[6-(4-benzyloxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]guanidine CAS Name: 2-[6-(4-phenylmethoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]guanidine IUPAC Name: 2-[6-(4-phenylmethoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]guanidine Traditional Name: 2-[6-(4-benzoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]guanidine Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=C(C=C3)OCC4=CC=CC=C4)SC(=N2)N=C(N)N

Isomeric SMILES

C1CC2=C(CC1C3=CC=C(C=C3)OCC4=CC=CC=C4)SC(=N2)N=C(N)N

InChI

InChI=1S/C21H22N4OS/c22-20(23)25-21-24-18-11-8-16(12-19(18)27-21)15-6-9-17(10-7-15)26-13-14-4-2-1-3-5-14/h1-7,9-10,16H,8,11-13H2,(H4,22,23,24,25)