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

Systemtic Name: 4-(2-methoxyethylamino)-N-(2-methyl-1,3-benzothiazol-6-yl)-3-nitro-benzamide Openeye Name: 4-(2-methoxyethylamino)-N-(2-methyl-1,3-benzothiazol-6-yl)-3-nitro-benzamide CAS Name: 4-(2-methoxyethylamino)-N-(2-methyl-1,3-benzothiazol-6-yl)-3-nitrobenzamide IUPAC Name: 4-(2-methoxyethylamino)-N-(2-methyl-1,3-benzothiazol-6-yl)-3-nitrobenzamide Traditional Name: 4-(2-methoxyethylamino)-N-(2-methyl-1,3-benzothiazol-6-yl)-3-nitro-benzamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-11-20-15-6-4-13(10-17(15)27-11)21-18(23)12-3-5-14(19-7-8-26-2)16(9-12)22(24)25/h3-6,9-10,19H,7-8H2,1-2H3,(H,21,23)