(5-methyl-1-propan-2-yl-pyrazol-3-yl)-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (5-methyl-1-propan-2-yl-pyrazol-3-yl)-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (1-isopropyl-5-methyl-pyrazol-3-yl)-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (5-methyl-1-propan-2-yl-3-pyrazolyl)-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (5-methyl-1-propan-2-ylpyrazol-3-yl)-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (1-isopropyl-5-methyl-pyrazol-3-yl)-[4-(4-mesyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C20H25N5O3S2 MolecularWeight: 447.5742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

CC1=CC(=NN1C(C)C)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C20H25N5O3S2/c1-13(2)25-14(3)12-15(22-25)19(26)23-8-10-24(11-9-23)20-21-18-16(29-20)6-5-7-17(18)30(4,27)28/h5-7,12-13H,8-11H2,1-4H3