2-(2-methoxyethylamino)-5-nitro-N-[4-(1H-pyrrol-2-yl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 2-(2-methoxyethylamino)-5-nitro-N-[4-(1H-pyrrol-2-yl)-1,3-thiazol-2-yl]benzamide Openeye Name: 2-(2-methoxyethylamino)-5-nitro-N-[4-(1H-pyrrol-2-yl)thiazol-2-yl]benzamide CAS Name: 2-(2-methoxyethylamino)-5-nitro-N-[4-(1H-pyrrol-2-yl)-2-thiazolyl]benzamide IUPAC Name: 2-(2-methoxyethylamino)-5-nitro-N-[4-(1H-pyrrol-2-yl)-1,3-thiazol-2-yl]benzamide Traditional Name: 2-(2-methoxyethylamino)-5-nitro-N-[4-(1H-pyrrol-2-yl)thiazol-2-yl]benzamide Formula: C17H17N5O4S MolecularWeight: 387.41298

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=CN3

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=CN3

InChI

InChI=1S/C17H17N5O4S/c1-26-8-7-19-13-5-4-11(22(24)25)9-12(13)16(23)21-17-20-15(10-27-17)14-3-2-6-18-14/h2-6,9-10,18-19H,7-8H2,1H3,(H,20,21,23)