N-(1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-morpholino-5-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-morpholino-5-nitro-benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC4=CC=CC=C4S3

InChI

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