1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(4-methylphenyl)amino]ethanoylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(4-methylphenyl)amino]ethanoylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(4-methylanilino)acetyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(4-methylanilino)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(4-methylanilino)acetyl]amino]thiourea Traditional Name: 1-piperonyl-3-[[2-(p-toluidino)acetyl]amino]thiourea Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)NCC(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N4O3S/c1-12-2-5-14(6-3-12)19-10-17(23)21-22-18(26)20-9-13-4-7-15-16(8-13)25-11-24-15/h2-8,19H,9-11H2,1H3,(H,21,23)(H2,20,22,26)