3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopropylmethyl)-1-propyl-thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopropylmethyl)-1-propyl-thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopropylmethyl)-1-propyl-thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopropylmethyl)-1-propylthiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopropylmethyl)-1-propylthiourea Traditional Name: 1-(cyclopropylmethyl)-3-piperonyl-1-propyl-thiourea Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CC1)C(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCN(CC1CC1)C(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N2O2S/c1-2-7-18(10-12-3-4-12)16(21)17-9-13-5-6-14-15(8-13)20-11-19-14/h5-6,8,12H,2-4,7,9-11H2,1H3,(H,17,21)