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

Systemtic Name: 1,3-dicyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Openeye Name: 1,3-dicyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea CAS Name: 1,3-dicyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea IUPAC Name: 1,3-dicyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Traditional Name: 1,3-dicyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N(CC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C4CC4

Isomeric SMILES

C1CC1NC(=S)N(CC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C4CC4

InChI

InChI=1S/C16H17N5O3S/c22-21(23)13-3-1-2-10(8-13)15-19-18-14(24-15)9-20(12-6-7-12)16(25)17-11-4-5-11/h1-3,8,11-12H,4-7,9H2,(H,17,25)