[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-methoxy-phenyl)methanone

Systemtic Name: [4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-methoxy-phenyl)methanone Openeye Name: [4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-(3-ethoxy-4-methoxy-phenyl)methanone CAS Name: [4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-(3-ethoxy-4-methoxyphenyl)methanone IUPAC Name: [4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-methoxyphenyl)methanone Traditional Name: [4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-(3-ethoxy-4-methoxy-phenyl)methanone Formula: C18H21ClN2O5S2 MolecularWeight: 444.95274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)OC

InChI

InChI=1S/C18H21ClN2O5S2/c1-3-26-15-12-13(4-5-14(15)25-2)18(22)20-8-10-21(11-9-20)28(23,24)17-7-6-16(19)27-17/h4-7,12H,3,8-11H2,1-2H3