N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: N-(2-morpholinoethyl)-4-nitro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide CAS Name: N-[2-(4-morpholinyl)ethyl]-4-nitro-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: N-(2-morpholin-4-ylethyl)-4-nitro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: N-[2-keto-2-(thiazol-2-ylamino)ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide Formula: C18H21N5O5S MolecularWeight: 419.45484

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(CC(=O)NC2=NC=CS2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCN(CC(=O)NC2=NC=CS2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O5S/c24-16(20-18-19-5-12-29-18)13-22(7-6-21-8-10-28-11-9-21)17(25)14-1-3-15(4-2-14)23(26)27/h1-5,12H,6-11,13H2,(H,19,20,24)