1-(1,3-benzodioxol-5-ylmethyl)-3-(pentan-3-ylideneamino)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(pentan-3-ylideneamino)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-ethylpropylideneamino)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(pentan-3-ylideneamino)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(pentan-3-ylideneamino)thiourea Traditional Name: 1-(1-ethylpropylideneamino)-3-piperonyl-thiourea Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=S)NCC1=CC2=C(C=C1)OCO2)CC

Isomeric SMILES

CCC(=NNC(=S)NCC1=CC2=C(C=C1)OCO2)CC

InChI

InChI=1S/C14H19N3O2S/c1-3-11(4-2)16-17-14(20)15-8-10-5-6-12-13(7-10)19-9-18-12/h5-7H,3-4,8-9H2,1-2H3,(H2,15,17,20)