N-(6-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-benzothiophene-2-carboxamide Formula: C23H22N4O4S2 MolecularWeight: 482.57518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O4S2/c1-15-2-4-18-20(12-15)33-23(24-18)26(7-6-25-8-10-31-11-9-25)22(28)21-14-16-13-17(27(29)30)3-5-19(16)32-21/h2-5,12-14H,6-11H2,1H3