N-(2-diethylaminoethyl)-2-(2,4-dimethylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: N-(2-diethylaminoethyl)-2-(2,4-dimethylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(2-diethylaminoethyl)-2-(2,4-dimethylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(2-diethylaminoethyl)-2-(2,4-dimethylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: N-(2-diethylaminoethyl)-2-(2,4-dimethylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(2-diethylaminoethyl)-2-(2,4-dimethylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-])C(=O)CC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-])C(=O)CC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C23H28N4O3S/c1-5-25(6-2)11-12-26(22(28)14-18-8-7-16(3)13-17(18)4)23-24-20-10-9-19(27(29)30)15-21(20)31-23/h7-10,13,15H,5-6,11-12,14H2,1-4H3