3-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-thienylmethyl)thiourea CAS Name: 3-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-thenyl)thiourea Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC1=CC=CS1)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCNC(=S)N(CC1=CC=CS1)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H22N2O2S2/c1-2-3-8-19-18(23)20(13-15-5-4-11-24-15)14-6-7-16-17(12-14)22-10-9-21-16/h4-7,11-12H,2-3,8-10,13H2,1H3,(H,19,23)