1-(2-methyl-3-nitro-phenyl)-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-(2-methyl-3-nitro-phenyl)-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-(2-methyl-3-nitro-phenyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-(2-methyl-3-nitrophenyl)-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-(2-methyl-3-nitrophenyl)-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-(2-methyl-3-nitro-phenyl)-3-(tetrahydrofurfuryl)thiourea Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NCC2CCCO2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NCC2CCCO2

InChI

InChI=1S/C13H17N3O3S/c1-9-11(5-2-6-12(9)16(17)18)15-13(20)14-8-10-4-3-7-19-10/h2,5-6,10H,3-4,7-8H2,1H3,(H2,14,15,20)