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

Systemtic Name: 4-chloranyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: 4-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C15H10ClN3O3S MolecularWeight: 347.7762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H10ClN3O3S/c1-8-3-2-4-12-13(8)17-15(23-12)18-14(20)10-6-5-9(16)7-11(10)19(21)22/h2-7H,1H3,(H,17,18,20)