1-(1,3-benzodioxol-5-yl)-3-[(2-methylfuran-3-yl)carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-methylfuran-3-yl)carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-methylfuran-3-carbonyl)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[[(2-methyl-3-furanyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-methylfuran-3-carbonyl)amino]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-methyl-3-furoyl)amino]thiourea Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C=CO1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H13N3O4S/c1-8-10(4-5-19-8)13(18)16-17-14(22)15-9-2-3-11-12(6-9)21-7-20-11/h2-6H,7H2,1H3,(H,16,18)(H2,15,17,22)