1-(3-chlorophenyl)-3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]thiourea Formula: C17H16ClN3O3S2 MolecularWeight: 409.91024

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H16ClN3O3S2/c18-11-2-1-3-12(8-11)19-17(25)21-20-16(22)10-26-13-4-5-14-15(9-13)24-7-6-23-14/h1-5,8-9H,6-7,10H2,(H,20,22)(H2,19,21,25)