N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-benzothiophene-2-carboxamide Formula: C20H17BrN4O3S2 MolecularWeight: 505.40798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17BrN4O3S2/c1-23(2)7-8-24(20-22-15-5-3-13(21)11-17(15)30-20)19(26)18-10-12-9-14(25(27)28)4-6-16(12)29-18/h3-6,9-11H,7-8H2,1-2H3