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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[ethyl-(3-methylphenyl)amino]ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(N-ethyl-3-methyl-anilino)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(N-ethyl-3-methylanilino)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(N-ethyl-3-methylanilino)ethyl]thiourea Traditional Name: 1-[2-(N-ethyl-3-methyl-anilino)ethyl]-3-piperonyl-thiourea Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=S)NCC1=CC2=C(C=C1)OCO2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=S)NCC1=CC2=C(C=C1)OCO2)C3=CC=CC(=C3)C

InChI

InChI=1S/C20H25N3O2S/c1-3-23(17-6-4-5-15(2)11-17)10-9-21-20(26)22-13-16-7-8-18-19(12-16)25-14-24-18/h4-8,11-12H,3,9-10,13-14H2,1-2H3,(H2,21,22,26)