N-[(1S)-2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]-4-methyl-benzamide

Systemtic Name: N-[(1S)-2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]-4-methyl-benzamide Openeye Name: N-[(1S)-2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-1-(p-tolylsulfonyl)ethyl]-4-methyl-benzamide CAS Name: N-[(1S)-2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-(4-methylphenyl)sulfonyl-2-oxoethyl]-4-methylbenzamide IUPAC Name: N-[(1S)-2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-(4-methylphenyl)sulfonyl-2-oxoethyl]-4-methylbenzamide Traditional Name: N-[(1S)-2-[4-(2-furoyl)piperazino]-2-keto-1-tosyl-ethyl]-4-methyl-benzamide Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(=O)N2CCN(CC2)C(=O)C3=CC=CO3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H](C(=O)N2CCN(CC2)C(=O)C3=CC=CO3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H27N3O6S/c1-18-5-9-20(10-6-18)23(30)27-24(36(33,34)21-11-7-19(2)8-12-21)26(32)29-15-13-28(14-16-29)25(31)22-4-3-17-35-22/h3-12,17,24H,13-16H2,1-2H3,(H,27,30)/t24-/m0/s1