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

Systemtic Name: 1-cyclopentyl-3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-cyclopentyl-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]thiourea Formula: C16H21N3O3S2 MolecularWeight: 367.48624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NNC(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCC(C1)NC(=S)NNC(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H21N3O3S2/c20-15(18-19-16(23)17-11-3-1-2-4-11)10-24-12-5-6-13-14(9-12)22-8-7-21-13/h5-6,9,11H,1-4,7-8,10H2,(H,18,20)(H2,17,19,23)