N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-methyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-methyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-methyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-methyl-N-[3-(4-morpholinyl)propyl]-3-pyrazolecarboxamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-methyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Traditional Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-methyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=NN(C=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=NN(C=C4)C

InChI

InChI=1S/C21H27N5O2S/c1-15-13-18-19(14-16(15)2)29-21(22-18)26(20(27)17-5-8-24(3)23-17)7-4-6-25-9-11-28-12-10-25/h5,8,13-14H,4,6-7,9-12H2,1-3H3