2-methyl-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]-1,3-benzothiazole-6-sulfonamide

Systemtic Name: 2-methyl-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]-1,3-benzothiazole-6-sulfonamide Openeye Name: 2-methyl-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]-1,3-benzothiazole-6-sulfonamide CAS Name: 2-methyl-N-[2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]oxy]ethyl]-1,3-benzothiazole-6-sulfonamide IUPAC Name: 2-methyl-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-methyl-N-[2-(6-pyrrolidinopyrimidin-4-yl)oxyethyl]-1,3-benzothiazole-6-sulfonamide Formula: C18H21N5O3S2 MolecularWeight: 419.52104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NCCOC3=NC=NC(=C3)N4CCCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NCCOC3=NC=NC(=C3)N4CCCC4

InChI

InChI=1S/C18H21N5O3S2/c1-13-22-15-5-4-14(10-16(15)27-13)28(24,25)21-6-9-26-18-11-17(19-12-20-18)23-7-2-3-8-23/h4-5,10-12,21H,2-3,6-9H2,1H3