[2-[[4-(3,4-dichlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone

Systemtic Name: [2-[[4-(3,4-dichlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone Openeye Name: [2-[[4-(3,4-dichlorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-4-yl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone CAS Name: [2-[[[4-(3,4-dichlorophenyl)-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolyl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone IUPAC Name: [2-[[4-(3,4-dichlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone Traditional Name: [2-[[[4-(3,4-dichlorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]thiazol-4-yl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone Formula: C27H27Cl2N5O2S2 MolecularWeight: 588.57158

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(C1)(CN2C(=O)C3=CSC(=N3)CSC4=NN=C(N4C5=CC(=C(C=C5)Cl)Cl)C6=CC=CO6)C)C

Isomeric SMILES

CC1(CC2CC(C1)(CN2C(=O)C3=CSC(=N3)CSC4=NN=C(N4C5=CC(=C(C=C5)Cl)Cl)C6=CC=CO6)C)C

InChI

InChI=1S/C27H27Cl2N5O2S2/c1-26(2)10-17-11-27(3,14-26)15-33(17)24(35)20-12-37-22(30-20)13-38-25-32-31-23(21-5-4-8-36-21)34(25)16-6-7-18(28)19(29)9-16/h4-9,12,17H,10-11,13-15H2,1-3H3