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

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]-3-phenyl-thiourea Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O3S2/c21-16(19-20-17(24)18-12-4-2-1-3-5-12)11-25-13-6-7-14-15(10-13)23-9-8-22-14/h1-7,10H,8-9,11H2,(H,19,21)(H2,18,20,24)