1-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(4-methoxy-3-nitro-phenyl)methyleneamino]thiourea CAS Name: 1-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(4-methoxy-3-nitro-benzylidene)amino]thiourea Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=S)NCC=C)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=S)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3S/c1-3-6-13-12(20)15-14-8-9-4-5-11(19-2)10(7-9)16(17)18/h3-5,7-8H,1,6H2,2H3,(H2,13,15,20)/b14-8+