N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1-isopropyl-pyrazole-3-carboxamide Formula: C20H26BrN5OS MolecularWeight: 464.42234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=NN(C=C3)C(C)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=NN(C=C3)C(C)C

InChI

InChI=1S/C20H26BrN5OS/c1-5-24(6-2)11-12-25(19(27)17-9-10-26(23-17)14(3)4)20-22-16-8-7-15(21)13-18(16)28-20/h7-10,13-14H,5-6,11-12H2,1-4H3