diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazol-3-yl)carbonyl-amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazol-3-yl)carbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-[(2-methyl-3-pyrazolyl)-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]ethyl]ammonium Formula: C20H28N5O2S+ MolecularWeight: 402.53362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)C3=CC=NN3C

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)C3=CC=NN3C

InChI

InChI=1S/C20H27N5O2S/c1-6-24(7-2)12-13-25(19(26)15-10-11-21-23(15)4)20-22-17-16(27-5)9-8-14(3)18(17)28-20/h8-11H,6-7,12-13H2,1-5H3/p+1