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

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-morpholino-5-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-morpholino-5-nitro-benzamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N4O4S/c24-19(20-12-18-21-15-3-1-2-4-17(15)28-18)14-11-13(23(25)26)5-6-16(14)22-7-9-27-10-8-22/h1-6,11H,7-10,12H2,(H,20,24)