N-[2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-6-morpholin-4-yl-pyrazine-2-carboxamide

Systemtic Name: N-[2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-6-morpholin-4-yl-pyrazine-2-carboxamide Openeye Name: N-[2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-6-morpholino-pyrazine-2-carboxamide CAS Name: N-[2-[[2-(diethylamino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-6-(4-morpholinyl)-2-pyrazinecarboxamide IUPAC Name: N-[2-[2-(diethylamino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-6-morpholin-4-ylpyrazine-2-carboxamide Traditional Name: N-[2-[[2-(diethylamino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]-6-morpholino-pyrazinamide Formula: C22H26N6O3S2 MolecularWeight: 486.61024

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CN=CC(=N3)N4CCOCC4

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CN=CC(=N3)N4CCOCC4

InChI

InChI=1S/C22H26N6O3S2/c1-3-27(4-2)20(29)14-32-22-26-16-6-5-15(11-18(16)33-22)24-21(30)17-12-23-13-19(25-17)28-7-9-31-10-8-28/h5-6,11-13H,3-4,7-10,14H2,1-2H3,(H,24,30)