1-[(E)-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[(E)-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[(E)-[5-(2-bromo-4-nitro-phenyl)-2-furyl]methyleneamino]-3-ethyl-thiourea CAS Name: 1-[(E)-[5-(2-bromo-4-nitrophenyl)-2-furanyl]methylideneamino]-3-ethylthiourea IUPAC Name: 1-[(E)-[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylideneamino]-3-ethylthiourea Traditional Name: 1-[(E)-[5-(2-bromo-4-nitro-phenyl)-2-furyl]methyleneamino]-3-ethyl-thiourea Formula: C14H13BrN4O3S MolecularWeight: 397.24702

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCNC(=S)N/N=C/C1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C14H13BrN4O3S/c1-2-16-14(23)18-17-8-10-4-6-13(22-10)11-5-3-9(19(20)21)7-12(11)15/h3-8H,2H2,1H3,(H2,16,18,23)/b17-8+