[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (1-benzyl-3,5-dimethyl-pyrazol-4-yl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: [3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (1-benzyl-3,5-dimethylpyrazol-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-benzyl-3,5-dimethyl-pyrazol-4-yl)-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H28N4O3S/c1-20-26(21(2)31(28-20)19-22-8-4-3-5-9-22)27(32)29-14-16-30(17-15-29)35(33,34)25-13-12-23-10-6-7-11-24(23)18-25/h3-13,18H,14-17,19H2,1-2H3