N-(2,1,3-benzothiadiazol-5-ylmethyl)-N,2-dimethyl-6-piperidin-4-yl-pyrimidin-4-amine

Systemtic Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-N,2-dimethyl-6-piperidin-4-yl-pyrimidin-4-amine Openeye Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-N,2-dimethyl-6-(4-piperidyl)pyrimidin-4-amine CAS Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-N,2-dimethyl-6-(4-piperidinyl)-4-pyrimidinamine IUPAC Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-N,2-dimethyl-6-piperidin-4-ylpyrimidin-4-amine Traditional Name: methyl-[2-methyl-6-(4-piperidyl)pyrimidin-4-yl]-(piazthiol-5-ylmethyl)amine Formula: C18H22N6S MolecularWeight: 354.47248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)CC2=CC3=NSN=C3C=C2)C4CCNCC4

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)CC2=CC3=NSN=C3C=C2)C4CCNCC4

InChI

InChI=1S/C18H22N6S/c1-12-20-16(14-5-7-19-8-6-14)10-18(21-12)24(2)11-13-3-4-15-17(9-13)23-25-22-15/h3-4,9-10,14,19H,5-8,11H2,1-2H3