1-(1,3-benzodioxol-5-ylmethyl)-3-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]thiourea Traditional Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]-3-piperonyl-thiourea Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N3O5S/c22-17(16-9-23-12-3-1-2-4-14(12)26-16)20-21-18(27)19-8-11-5-6-13-15(7-11)25-10-24-13/h1-7,16H,8-10H2,(H,20,22)(H2,19,21,27)/t16-/m0/s1