1-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(tetrahydrofurfuryl)thiourea Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O3S/c1-10-5-6-12(8-14(10)19(20)21)11(2)17-18-15(23)16-9-13-4-3-7-22-13/h5-6,8,13H,3-4,7,9H2,1-2H3,(H2,16,18,23)/b17-11+