4-(1,2-benzothiazol-3-yl)-N'-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carboximidamide

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N'-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carboximidamide Openeye Name: 4-(1,2-benzothiazol-3-yl)-N'-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carboxamidine CAS Name: 4-(1,2-benzothiazol-3-yl)-N'-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinecarboximidamide IUPAC Name: 4-(1,2-benzothiazol-3-yl)-N'-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carboximidamide Traditional Name: 4-(1,2-benzothiazol-3-yl)-N'-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carboxamidine Formula: C18H21N7S MolecularWeight: 367.47124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N)N2CCN(CC2)C3=NSC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=NC(=N1)N=C(N)N2CCN(CC2)C3=NSC4=CC=CC=C43)C

InChI

InChI=1S/C18H21N7S/c1-12-11-13(2)21-18(20-12)22-17(19)25-9-7-24(8-10-25)16-14-5-3-4-6-15(14)26-23-16/h3-6,11H,7-10H2,1-2H3,(H2,19,20,21,22)