1-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-pentan-2-yl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-pentan-2-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1S)-1-methylbutyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-pentan-2-yl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-pentan-2-yl]thiourea Traditional Name: 1-[(1S)-1-methylbutyl]-3-piperonyl-thiourea Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC[C@H](C)NC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H20N2O2S/c1-3-4-10(2)16-14(19)15-8-11-5-6-12-13(7-11)18-9-17-12/h5-7,10H,3-4,8-9H2,1-2H3,(H2,15,16,19)/t10-/m0/s1