N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide

Systemtic Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Openeye Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide CAS Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide IUPAC Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide Traditional Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Formula: C17H15N3O3S MolecularWeight: 341.3843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N2C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N2C

InChI

InChI=1S/C17H15N3O3S/c1-3-11-6-5-9-14-15(11)19(2)17(24-14)18-16(21)12-7-4-8-13(10-12)20(22)23/h4-10H,3H2,1-2H3