(3R)-4-(3,4-dichlorophenyl)sulfonyl-3-[[1-[(7R)-1,2,3,4,7,8,9,10-octahydrobenzo[f]isoquinolin-7-yl]-1,2,3-triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one

Systemtic Name: (3R)-4-(3,4-dichlorophenyl)sulfonyl-3-[[1-[(7R)-1,2,3,4,7,8,9,10-octahydrobenzo[f]isoquinolin-7-yl]-1,2,3-triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one Openeye Name: (3R)-4-(3,4-dichlorophenyl)sulfonyl-3-[[1-[(7R)-1,2,3,4,7,8,9,10-octahydrobenzo[f]isoquinolin-7-yl]triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one CAS Name: (3R)-4-(3,4-dichlorophenyl)sulfonyl-3-[[1-[(7R)-1,2,3,4,7,8,9,10-octahydrobenzo[f]isoquinolin-7-yl]-4-triazolyl]methyl]-1,3-dihydropyrazin-2-one IUPAC Name: (3R)-4-(3,4-dichlorophenyl)sulfonyl-3-[[1-[(7R)-1,2,3,4,7,8,9,10-octahydrobenzo[f]isoquinolin-7-yl]triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one Traditional Name: (3R)-4-(3,4-dichlorophenyl)sulfonyl-3-[[1-[(7R)-1,2,3,4,7,8,9,10-octahydrobenz[f]isoquinolin-7-yl]triazol-4-yl]methyl]-1,3-dihydropyrazin-2-one Formula: C26H26Cl2N6O3S MolecularWeight: 573.49404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C3=C(CNCC3)C=C2)N4C=C(N=N4)CC5C(=O)NC=CN5S(=O)(=O)C6=CC(=C(C=C6)Cl)Cl

Isomeric SMILES

C1C[C@H](C2=C(C1)C3=C(CNCC3)C=C2)N4C=C(N=N4)C[C@@H]5C(=O)NC=CN5S(=O)(=O)C6=CC(=C(C=C6)Cl)Cl

InChI

InChI=1S/C26H26Cl2N6O3S/c27-22-7-5-18(13-23(22)28)38(36,37)34-11-10-30-26(35)25(34)12-17-15-33(32-31-17)24-3-1-2-20-19-8-9-29-14-16(19)4-6-21(20)24/h4-7,10-11,13,15,24-25,29H,1-3,8-9,12,14H2,(H,30,35)/t24-,25-/m1/s1