N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylamino)-5-nitro-benzamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylamino)-5-nitro-benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylamino)-5-nitro-benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylamino)-5-nitrobenzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylamino)-5-nitrobenzamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylamino)-5-nitro-benzamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCOC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCOC)C

InChI

InChI=1S/C19H20N4O4S/c1-11-8-12(2)17-16(9-11)28-19(21-17)22-18(24)14-10-13(23(25)26)4-5-15(14)20-6-7-27-3/h4-5,8-10,20H,6-7H2,1-3H3,(H,21,22,24)