N-(1,3-benzothiazol-2-ylmethyl)-4-ethoxy-N-methyl-3-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-ethoxy-N-methyl-3-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-ethoxy-N-methyl-3-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-ethoxy-N-methyl-3-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-ethoxy-N-methyl-3-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-ethoxy-N-methyl-3-nitro-benzamide Formula: C18H17N3O4S MolecularWeight: 371.41028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N(C)CC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N(C)CC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c1-3-25-15-9-8-12(10-14(15)21(23)24)18(22)20(2)11-17-19-13-6-4-5-7-16(13)26-17/h4-10H,3,11H2,1-2H3