4-[[7-bromanyl-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]-1,3-thiazole

Systemtic Name: 4-[[7-bromanyl-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]-1,3-thiazole Openeye Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]thiazole CAS Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]thiazole IUPAC Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]-1,3-thiazole Traditional Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-mesyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]thiazole Formula: C18H20BrN5O2S2 MolecularWeight: 482.4177

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CSC=N3)CC4=CN=CN4

Isomeric SMILES

CS(=O)(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CSC=N3)CC4=CN=CN4

InChI

InChI=1S/C18H20BrN5O2S2/c1-28(25,26)24-7-13-4-14(19)2-3-18(13)23(8-16-6-20-11-21-16)9-17(24)5-15-10-27-12-22-15/h2-4,6,10-12,17H,5,7-9H2,1H3,(H,20,21)