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

Systemtic Name: 3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-nitro-benzamide Openeye Name: 3-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)-4-nitro-benzamide CAS Name: 3-methyl-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-nitrobenzamide Traditional Name: 3-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)-4-nitro-benzamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4S/c1-12-10-13(2-5-16(12)23(25)26)18(24)20-14-3-4-15-17(11-14)28-19(21-15)22-6-8-27-9-7-22/h2-5,10-11H,6-9H2,1H3,(H,20,24)