3-[(4-quinolin-8-ylsulfonylpiperazin-1-yl)methyl]-7-thiophen-2-yl-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide

Systemtic Name: 3-[(4-quinolin-8-ylsulfonylpiperazin-1-yl)methyl]-7-thiophen-2-yl-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide Openeye Name: 3-[[4-(8-quinolylsulfonyl)piperazin-1-yl]methyl]-7-(2-thienyl)-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide CAS Name: 3-[[4-(8-quinolinylsulfonyl)-1-piperazinyl]methyl]-7-thiophen-2-yl-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide IUPAC Name: 3-[(4-quinolin-8-ylsulfonylpiperazin-1-yl)methyl]-7-thiophen-2-yl-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide Traditional Name: 3-[[4-(8-quinolylsulfonyl)piperazino]methyl]-7-(2-thienyl)-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide Formula: C25H23N5O4S3 MolecularWeight: 553.67622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NS(=O)(=O)C3=C(N2)C=CC(=C3)C4=CC=CS4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=NS(=O)(=O)C3=C(N2)C=CC(=C3)C4=CC=CS4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C25H23N5O4S3/c31-36(32)23-16-19(21-6-3-15-35-21)8-9-20(23)27-24(28-36)17-29-11-13-30(14-12-29)37(33,34)22-7-1-4-18-5-2-10-26-25(18)22/h1-10,15-16H,11-14,17H2,(H,27,28)