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

Systemtic Name: 1-[(E)-1-(4-chloranyl-3-nitro-phenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(E)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(E)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(E)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[(E)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-(tetrahydrofurfuryl)thiourea Formula: C14H17ClN4O3S MolecularWeight: 356.82778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN4O3S/c1-9(10-4-5-12(15)13(7-10)19(20)21)17-18-14(23)16-8-11-3-2-6-22-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,16,18,23)/b17-9+