1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea Traditional Name: 1-piperonyl-3-(p-phenetylthiocarbamoylamino)thiourea Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N4O3S2/c1-2-23-14-6-4-13(5-7-14)20-18(27)22-21-17(26)19-10-12-3-8-15-16(9-12)25-11-24-15/h3-9H,2,10-11H2,1H3,(H2,19,21,26)(H2,20,22,27)