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

Systemtic Name: N-(2-dimethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-benzothiophene-2-carboxamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CCN(C)C)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CCN(C)C)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O3S2/c1-13-9-17-19(10-14(13)2)31-22(23-17)25(8-7-24(3)4)21(27)20-12-15-11-16(26(28)29)5-6-18(15)30-20/h5-6,9-12H,7-8H2,1-4H3