(E)-1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3-methoxy-4-propoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3-methoxy-4-propoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-3-(3-methoxy-4-propoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-(3-methoxy-4-propoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3-methoxy-4-propoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-3-(3-methoxy-4-propoxy-phenyl)prop-2-en-1-one Formula: C21H25ClN2O5S2 MolecularWeight: 485.0166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O5S2/c1-3-14-29-17-6-4-16(15-18(17)28-2)5-8-20(25)23-10-12-24(13-11-23)31(26,27)21-9-7-19(22)30-21/h4-9,15H,3,10-14H2,1-2H3/b8-5+