[4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)methanone

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-(3-mesyl-6,7-dihydroisobenzothiophen-1-yl)methanone Formula: C22H28N2O3S3 MolecularWeight: 464.66432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C4CCC=CC4=C(S3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C4CCC=CC4=C(S3)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O3S3/c1-22(2,3)17-13-28-19(23-17)14-9-11-24(12-10-14)20(25)18-15-7-5-6-8-16(15)21(29-18)30(4,26)27/h6,8,13-14H,5,7,9-12H2,1-4H3