N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-[3-(4-morpholinyl)propyl]-3-pyrazolecarboxamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C21H26ClN5O2S MolecularWeight: 447.98144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=NN(C=C4C)C

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=NN(C=C4C)C

InChI

InChI=1S/C21H26ClN5O2S/c1-14-5-6-16(22)19-17(14)23-21(30-19)27(8-4-7-26-9-11-29-12-10-26)20(28)18-15(2)13-25(3)24-18/h5-6,13H,4,7-12H2,1-3H3