N-(furan-2-ylmethyl)-4-[(E)-2-phenylethenyl]sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[(E)-2-phenylethenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NCC2=CC=CO2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=S)NCC2=CC=CO2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S2/c22-26(23,14-8-16-5-2-1-3-6-16)21-11-9-20(10-12-21)18(25)19-15-17-7-4-13-24-17/h1-8,13-14H,9-12,15H2,(H,19,25)/b14-8+