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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-morpholino-5-nitro-benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-morpholino-5-nitro-benzamide Formula: C18H15ClN4O4S MolecularWeight: 418.8541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C18H15ClN4O4S/c19-13-2-1-3-15-16(13)20-18(28-15)21-17(24)12-10-11(23(25)26)4-5-14(12)22-6-8-27-9-7-22/h1-5,10H,6-9H2,(H,20,21,24)