N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: 1-isopropyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: 1-isopropyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CC(=N1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC(=C4)OC

Isomeric SMILES

CC(C)N1C=CC(=N1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC(=C4)OC

InChI

InChI=1S/C22H29N5O3S/c1-16(2)27-10-7-18(24-27)21(28)26(9-4-8-25-11-13-30-14-12-25)22-23-19-15-17(29-3)5-6-20(19)31-22/h5-7,10,15-16H,4,8-9,11-14H2,1-3H3