[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-(3,4-dipropoxyphenyl)methanone

Systemtic Name: [4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-(3,4-dipropoxyphenyl)methanone Openeye Name: [4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-(3,4-dipropoxyphenyl)methanone CAS Name: [4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-(3,4-dipropoxyphenyl)methanone IUPAC Name: [4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-(3,4-dipropoxyphenyl)methanone Traditional Name: [4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-(3,4-dipropoxyphenyl)methanone Formula: C21H27ClN2O5S2 MolecularWeight: 487.03248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)OCCC

InChI

InChI=1S/C21H27ClN2O5S2/c1-3-13-28-17-6-5-16(15-18(17)29-14-4-2)21(25)23-9-11-24(12-10-23)31(26,27)20-8-7-19(22)30-20/h5-8,15H,3-4,9-14H2,1-2H3