1-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-(tetrahydrofurfuryl)thiourea Formula: C14H18N4O3S MolecularWeight: 322.38272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1CCCO1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=S)NCC1CCCO1)/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O3S/c1-10(11-4-6-12(7-5-11)18(19)20)16-17-14(22)15-9-13-3-2-8-21-13/h4-7,13H,2-3,8-9H2,1H3,(H2,15,17,22)/b16-10+