1-(1,3-benzodioxol-5-ylmethyl)-3-[(3R,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3R,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3R,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3R,5S)-5-methyl-2-oxo-3-oxolanyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3R,5S)-5-methyl-2-oxooxolan-3-yl]thiourea Traditional Name: 1-[(3R,5S)-2-keto-5-methyl-tetrahydrofuran-3-yl]-3-piperonyl-thiourea Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H]1C[C@H](C(=O)O1)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H16N2O4S/c1-8-4-10(13(17)20-8)16-14(21)15-6-9-2-3-11-12(5-9)19-7-18-11/h2-3,5,8,10H,4,6-7H2,1H3,(H2,15,16,21)/t8-,10+/m0/s1