1-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-propan-2-yl-guanidine; methanesulfonic acid

Systemtic Name: 1-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-propan-2-yl-guanidine; methanesulfonic acid Openeye Name: 1-[4,5-bis(4-methoxyphenyl)thiazol-2-yl]-2-isopropyl-guanidine; methanesulfonic acid CAS Name: 1-[4,5-bis(4-methoxyphenyl)-2-thiazolyl]-2-propan-2-ylguanidine; methanesulfonic acid IUPAC Name: 1-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-propan-2-ylguanidine; methanesulfonic acid Traditional Name: 1-[4,5-bis(4-methoxyphenyl)thiazol-2-yl]-2-isopropyl-guanidine; mesylic acid Formula: C22H28N4O5S2 MolecularWeight: 492.61152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(N)NC1=NC(=C(S1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC.CS(=O)(=O)O

Isomeric SMILES

CC(C)N=C(N)NC1=NC(=C(S1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC.CS(=O)(=O)O

InChI

InChI=1S/C21H24N4O2S.CH4O3S/c1-13(2)23-20(22)25-21-24-18(14-5-9-16(26-3)10-6-14)19(28-21)15-7-11-17(27-4)12-8-15;1-5(2,3)4/h5-13H,1-4H3,(H3,22,23,24,25);1H3,(H,2,3,4)