1-(3-methylbutyl)-3-[4-(4-methylphenoxy)butanoylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[4-(4-methylphenoxy)butanoylamino]thiourea Openeye Name: 1-isopentyl-3-[4-(4-methylphenoxy)butanoylamino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[4-(4-methylphenoxy)-1-oxobutyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[4-(4-methylphenoxy)butanoylamino]thiourea Traditional Name: 1-isoamyl-3-[4-(4-methylphenoxy)butanoylamino]thiourea Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCC(=O)NNC(=S)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCCC(=O)NNC(=S)NCCC(C)C

InChI

InChI=1S/C17H27N3O2S/c1-13(2)10-11-18-17(23)20-19-16(21)5-4-12-22-15-8-6-14(3)7-9-15/h6-9,13H,4-5,10-12H2,1-3H3,(H,19,21)(H2,18,20,23)