3-(3-methylsulfanylpropyl)-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-yl-thiourea

Systemtic Name: 3-(3-methylsulfanylpropyl)-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-(3-methylsulfanylpropyl)-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea CAS Name: 3-[3-(methylthio)propyl]-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-ylthiourea IUPAC Name: 3-(3-methylsulfanylpropyl)-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-[3-(methylthio)propyl]-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Formula: C17H23N5O3S2 MolecularWeight: 409.52622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5O3S2/c1-12(2)21(17(26)18-9-4-10-27-3)11-15-19-20-16(25-15)13-5-7-14(8-6-13)22(23)24/h5-8,12H,4,9-11H2,1-3H3,(H,18,26)