1-methyl-3-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea

Systemtic Name: 1-methyl-3-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Openeye Name: 1-methyl-3-[[(Z)-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea CAS Name: 1-methyl-3-[[(Z)-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]thiourea IUPAC Name: 1-methyl-3-[[(Z)-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Traditional Name: 1-[[(Z)-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-methyl-thiourea Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC=C1C=C(C=CC1=O)[N+](=O)[O-]

Isomeric SMILES

CNC(=S)NN/C=C\1/C=C(C=CC1=O)[N+](=O)[O-]

InChI

InChI=1S/C9H10N4O3S/c1-10-9(17)12-11-5-6-4-7(13(15)16)2-3-8(6)14/h2-5,11H,1H3,(H2,10,12,17)/b6-5-