1-[(E)-(3-methyl-2-nitro-imidazol-4-yl)methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(3-methyl-2-nitro-imidazol-4-yl)methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(3-methyl-2-nitro-imidazol-4-yl)methyleneamino]thiourea CAS Name: 1-[(E)-(3-methyl-2-nitro-4-imidazolyl)methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(3-methyl-2-nitroimidazol-4-yl)methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(3-methyl-2-nitro-imidazol-4-yl)methyleneamino]thiourea Formula: C9H12N6O2S MolecularWeight: 268.29558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1[N+](=O)[O-])C=NNC(=S)NCC=C

Isomeric SMILES

CN1C(=CN=C1[N+](=O)[O-])/C=N/NC(=S)NCC=C

InChI

InChI=1S/C9H12N6O2S/c1-3-4-10-8(18)13-12-6-7-5-11-9(14(7)2)15(16)17/h3,5-6H,1,4H2,2H3,(H2,10,13,18)/b12-6+