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

Systemtic Name: 3-methyl-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-methyl-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea CAS Name: 3-methyl-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-ylthiourea IUPAC Name: 3-methyl-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-methyl-1-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Formula: C14H17N5O3S MolecularWeight: 335.38148

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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)NC

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O3S/c1-9(2)18(14(23)15-3)8-12-16-17-13(22-12)10-4-6-11(7-5-10)19(20)21/h4-7,9H,8H2,1-3H3,(H,15,23)