5,7-bis(chloranyl)-3-methyl-N-(3-methyl-4-piperazin-1-yl-quinolin-6-yl)-1-benzothiophene-2-sulfonamide

Systemtic Name: 5,7-bis(chloranyl)-3-methyl-N-(3-methyl-4-piperazin-1-yl-quinolin-6-yl)-1-benzothiophene-2-sulfonamide Openeye Name: 5,7-dichloro-3-methyl-N-(3-methyl-4-piperazin-1-yl-6-quinolyl)benzothiophene-2-sulfonamide CAS Name: 5,7-dichloro-3-methyl-N-[3-methyl-4-(1-piperazinyl)-6-quinolinyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5,7-dichloro-3-methyl-N-(3-methyl-4-piperazin-1-ylquinolin-6-yl)-1-benzothiophene-2-sulfonamide Traditional Name: 5,7-dichloro-3-methyl-N-(3-methyl-4-piperazino-6-quinolyl)benzothiophene-2-sulfonamide Formula: C23H22Cl2N4O2S2 MolecularWeight: 521.48238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C=CC(=CC2=C1N3CCNCC3)NS(=O)(=O)C4=C(C5=CC(=CC(=C5S4)Cl)Cl)C

Isomeric SMILES

CC1=CN=C2C=CC(=CC2=C1N3CCNCC3)NS(=O)(=O)C4=C(C5=CC(=CC(=C5S4)Cl)Cl)C

InChI

InChI=1S/C23H22Cl2N4O2S2/c1-13-12-27-20-4-3-16(11-18(20)21(13)29-7-5-26-6-8-29)28-33(30,31)23-14(2)17-9-15(24)10-19(25)22(17)32-23/h3-4,9-12,26,28H,5-8H2,1-2H3