1-tert-butyl-3-[2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanoylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanoylamino]thiourea Openeye Name: 1-tert-butyl-3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-oxoethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]amino]thiourea Formula: C16H23N3O2S3 MolecularWeight: 385.56772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)COC1=CC=C(C=C1)C2SCCS2

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)COC1=CC=C(C=C1)C2SCCS2

InChI

InChI=1S/C16H23N3O2S3/c1-16(2,3)17-15(22)19-18-13(20)10-21-12-6-4-11(5-7-12)14-23-8-9-24-14/h4-7,14H,8-10H2,1-3H3,(H,18,20)(H2,17,19,22)