3-(1,3-benzodioxol-5-yl)-1-[(4-ethoxyphenyl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[(4-ethoxyphenyl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-benzyl-1-[(4-ethoxyphenyl)methyl]thiourea CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[(4-ethoxyphenyl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-benzyl-1-[(4-ethoxyphenyl)methyl]thiourea Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-benzyl-1-(4-ethoxybenzyl)thiourea Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H24N2O3S/c1-2-27-21-11-8-19(9-12-21)16-26(15-18-6-4-3-5-7-18)24(30)25-20-10-13-22-23(14-20)29-17-28-22/h3-14H,2,15-17H2,1H3,(H,25,30)