N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-1-isopropyl-pyrazole-3-carboxamide Formula: C21H29N5OS MolecularWeight: 399.55286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCCN(C)C)C(=O)C3=NN(C=C3)C(C)C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCCN(C)C)C(=O)C3=NN(C=C3)C(C)C

InChI

InChI=1S/C21H29N5OS/c1-6-16-9-7-10-18-19(16)22-21(28-18)25(13-8-12-24(4)5)20(27)17-11-14-26(23-17)15(2)3/h7,9-11,14-15H,6,8,12-13H2,1-5H3