2-(4,6-dimethylpyrimidin-2-yl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]guanidine

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]guanidine Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]guanidine CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]guanidine IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]guanidine Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]guanidine Formula: C21H20N6S MolecularWeight: 388.4887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=NC4=NC(=CC(=N4)C)C)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N/C(=N/C4=NC(=CC(=N4)C)C)/N

InChI

InChI=1S/C21H20N6S/c1-12-4-9-17-18(10-12)28-19(26-17)15-5-7-16(8-6-15)25-20(22)27-21-23-13(2)11-14(3)24-21/h4-11H,1-3H3,(H3,22,23,24,25,27)