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

Systemtic Name: 4-[[7-bromanyl-1-(1H-imidazol-5-ylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]-1,3-thiazole Openeye Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]thiazole CAS Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]thiazole IUPAC Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]-1,3-thiazole Traditional Name: 4-[[7-bromo-1-(1H-imidazol-5-ylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-3-yl]methyl]thiazole Formula: C20H24BrN5O2S2 MolecularWeight: 510.47086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24BrN5O2S2/c1-2-5-30(27,28)26-9-15-6-16(21)3-4-20(15)25(10-18-8-22-13-23-18)11-19(26)7-17-12-29-14-24-17/h3-4,6,8,12-14,19H,2,5,7,9-11H2,1H3,(H,22,23)