1-(3-methylbutyl)-3-(4-phenoxybutanoylamino)thiourea

Systemtic Name: 1-(3-methylbutyl)-3-(4-phenoxybutanoylamino)thiourea Openeye Name: 1-isopentyl-3-(4-phenoxybutanoylamino)thiourea CAS Name: 1-(3-methylbutyl)-3-[(1-oxo-4-phenoxybutyl)amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-(4-phenoxybutanoylamino)thiourea Traditional Name: 1-isoamyl-3-(4-phenoxybutanoylamino)thiourea Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CCCOC1=CC=CC=C1

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CCCOC1=CC=CC=C1

InChI

InChI=1S/C16H25N3O2S/c1-13(2)10-11-17-16(22)19-18-15(20)9-6-12-21-14-7-4-3-5-8-14/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,18,20)(H2,17,19,22)