[1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)vinyl]isoxazol-4-yl]sulfonyl-4-piperidyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-4-isoxazolyl]sulfonyl]-4-piperidinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-[5-[(E)-2-mesitylvinyl]-3-methyl-isoxazol-4-yl]sulfonyl-4-piperidyl]-(4-phenylpiperazino)methanone Formula: C31H38N4O4S MolecularWeight: 562.72282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=CC2=C(C(=NO2)C)S(=O)(=O)N3CCC(CC3)C(=O)N4CCN(CC4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C=C/C2=C(C(=NO2)C)S(=O)(=O)N3CCC(CC3)C(=O)N4CCN(CC4)C5=CC=CC=C5)C

InChI

InChI=1S/C31H38N4O4S/c1-22-20-23(2)28(24(3)21-22)10-11-29-30(25(4)32-39-29)40(37,38)35-14-12-26(13-15-35)31(36)34-18-16-33(17-19-34)27-8-6-5-7-9-27/h5-11,20-21,26H,12-19H2,1-4H3/b11-10+