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

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-nitro-benzamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-nitro-benzamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-2-nitrobenzamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-nitrobenzamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-nitro-benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c23-17(13-3-1-2-4-15(13)22(24)25)19-12-5-6-14-16(11-12)27-18(20-14)21-7-9-26-10-8-21/h1-6,11H,7-10H2,(H,19,23)