1-pentyl-3-[[4-(propan-2-yloxymethyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-pentyl-3-[[4-(propan-2-yloxymethyl)phenyl]carbonylamino]thiourea Openeye Name: 1-[[4-(isopropoxymethyl)benzoyl]amino]-3-pentyl-thiourea CAS Name: 1-[[oxo-[4-(propan-2-yloxymethyl)phenyl]methyl]amino]-3-pentylthiourea IUPAC Name: 1-pentyl-3-[[4-(propan-2-yloxymethyl)benzoyl]amino]thiourea Traditional Name: 1-amyl-3-[[4-(isopropoxymethyl)benzoyl]amino]thiourea Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC=C(C=C1)COC(C)C

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC=C(C=C1)COC(C)C

InChI

InChI=1S/C17H27N3O2S/c1-4-5-6-11-18-17(23)20-19-16(21)15-9-7-14(8-10-15)12-22-13(2)3/h7-10,13H,4-6,11-12H2,1-3H3,(H,19,21)(H2,18,20,23)