1-[[(E)-(6-oxidanylidene-4-pyrrolidin-1-yl-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea

Systemtic Name: 1-[[(E)-(6-oxidanylidene-4-pyrrolidin-1-yl-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Openeye Name: [[(E)-(6-oxo-4-pyrrolidin-1-yl-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea CAS Name: [[(E)-[6-oxo-4-(1-pyrrolidinyl)-1-cyclohexa-2,4-dienylidene]methyl]amino]thiourea IUPAC Name: [[(E)-(6-oxo-4-pyrrolidin-1-ylcyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Traditional Name: [[(E)-(6-keto-4-pyrrolidino-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=O)C(=CNNC(=S)N)C=C2

Isomeric SMILES

C1CCN(C1)C2=CC(=O)/C(=C/NNC(=S)N)/C=C2

InChI

InChI=1S/C12H16N4OS/c13-12(18)15-14-8-9-3-4-10(7-11(9)17)16-5-1-2-6-16/h3-4,7-8,14H,1-2,5-6H2,(H3,13,15,18)/b9-8+