5-methyl-2-pyrrol-1-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonyl-furan-3-carbonitrile

Systemtic Name: 5-methyl-2-pyrrol-1-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonyl-furan-3-carbonitrile Openeye Name: 5-methyl-2-pyrrol-1-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]furan-3-carbonitrile CAS Name: 5-methyl-4-[oxo-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]methyl]-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 5-methyl-2-pyrrol-1-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]furan-3-carbonitrile Traditional Name: 5-methyl-2-pyrrol-1-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]-3-furonitrile Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(OC(=C3C#N)N4C=CC=C4)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(OC(=C3C#N)N4C=CC=C4)C)C)C

InChI

InChI=1S/C25H28N4O4S/c1-16-14-17(2)19(4)23(18(16)3)34(31,32)29-12-10-27(11-13-29)24(30)22-20(5)33-25(21(22)15-26)28-8-6-7-9-28/h6-9,14H,10-13H2,1-5H3