N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-nitro-benzamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-nitro-benzamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-nitro-benzamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-nitrobenzamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-nitrobenzamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-nitro-benzamide Formula: C18H17N3O3S MolecularWeight: 355.41088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-11-8-9-13(10-15(11)21(23)24)18(22)20(3)12(2)17-19-14-6-4-5-7-16(14)25-17/h4-10,12H,1-3H3