1-pentyl-3-(2-phenylsulfanylethanoylamino)thiourea

Systemtic Name: 1-pentyl-3-(2-phenylsulfanylethanoylamino)thiourea Openeye Name: 1-pentyl-3-[(2-phenylsulfanylacetyl)amino]thiourea CAS Name: 1-[[1-oxo-2-(phenylthio)ethyl]amino]-3-pentylthiourea IUPAC Name: 1-pentyl-3-[(2-phenylsulfanylacetyl)amino]thiourea Traditional Name: 1-amyl-3-[[2-(phenylthio)acetyl]amino]thiourea Formula: C14H21N3OS2 MolecularWeight: 311.46604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)CSC1=CC=CC=C1

Isomeric SMILES

CCCCCNC(=S)NNC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C14H21N3OS2/c1-2-3-7-10-15-14(19)17-16-13(18)11-20-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3,(H,16,18)(H2,15,17,19)