4-methyl-5-[4-methyl-5-[3-(7-piperidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]-1,2,4-triazol-3-yl]-1,3-thiazole

Systemtic Name: 4-methyl-5-[4-methyl-5-[3-(7-piperidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]-1,2,4-triazol-3-yl]-1,3-thiazole Openeye Name: 4-methyl-5-[4-methyl-5-[3-[7-(1-piperidylsulfonyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylsulfanyl]-1,2,4-triazol-3-yl]thiazole CAS Name: 4-methyl-5-[4-methyl-5-[3-[7-(1-piperidinylsulfonyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylthio]-1,2,4-triazol-3-yl]thiazole IUPAC Name: 4-methyl-5-[4-methyl-5-[3-(7-piperidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]-1,2,4-triazol-3-yl]-1,3-thiazole Traditional Name: 4-methyl-5-[4-methyl-5-[3-(7-piperidinosulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)propylthio]-1,2,4-triazol-3-yl]thiazole Formula: C24H32N6O2S3 MolecularWeight: 532.74488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C2=NN=C(N2C)SCCCN3CCC4=C(C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=C(SC=N1)C2=NN=C(N2C)SCCCN3CCC4=C(C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C24H32N6O2S3/c1-18-22(34-17-25-18)23-26-27-24(28(23)2)33-14-6-10-29-13-9-19-7-8-21(15-20(19)16-29)35(31,32)30-11-4-3-5-12-30/h7-8,15,17H,3-6,9-14,16H2,1-2H3