1-methyl-3-[[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-yl-amino]methyl]imidazole-2-thione

Systemtic Name: 1-methyl-3-[[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-yl-amino]methyl]imidazole-2-thione Openeye Name: 1-[[isopropyl-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]amino]methyl]-3-methyl-imidazole-2-thione CAS Name: 1-methyl-3-[[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-ylamino]methyl]-2-imidazolethione IUPAC Name: 1-methyl-3-[[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-ylamino]methyl]imidazole-2-thione Traditional Name: 1-[[isopropyl-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]amino]methyl]-3-methyl-4-imidazoline-2-thione Formula: C17H20N6O3S MolecularWeight: 388.4441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NN=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])CN3C=CN(C3=S)C

Isomeric SMILES

CC(C)N(CC1=NN=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])CN3C=CN(C3=S)C

InChI

InChI=1S/C17H20N6O3S/c1-12(2)22(11-21-8-7-20(3)17(21)27)10-15-18-19-16(26-15)13-5-4-6-14(9-13)23(24)25/h4-9,12H,10-11H2,1-3H3