[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone

Systemtic Name: [4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Openeye Name: (3-pyrrol-1-yl-2-thienyl)-[4-[(E)-styryl]sulfonylpiperazin-1-yl]methanone CAS Name: [4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-[3-(1-pyrrolyl)-2-thiophenyl]methanone IUPAC Name: [4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Traditional Name: (3-pyrrol-1-yl-2-thienyl)-[4-[(E)-styryl]sulfonylpiperazino]methanone Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(C=CS2)N3C=CC=C3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(C=CS2)N3C=CC=C3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S2/c25-21(20-19(8-16-28-20)22-10-4-5-11-22)23-12-14-24(15-13-23)29(26,27)17-9-18-6-2-1-3-7-18/h1-11,16-17H,12-15H2/b17-9+