1-[[(2R)-2-[(2R)-2-oxidanyl-3-propoxy-propyl]hexanoyl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[(2R)-2-[(2R)-2-oxidanyl-3-propoxy-propyl]hexanoyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-propoxy-propyl]hexanoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-propoxypropyl]-1-oxohexyl]amino]-3-phenylthiourea IUPAC Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-propoxypropyl]hexanoyl]amino]-3-phenylthiourea Traditional Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-propoxy-propyl]hexanoyl]amino]-3-phenyl-thiourea Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(COCCC)O)C(=O)NNC(=S)NC1=CC=CC=C1

Isomeric SMILES

CCCC[C@H](C[C@H](COCCC)O)C(=O)NNC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C19H31N3O3S/c1-3-5-9-15(13-17(23)14-25-12-4-2)18(24)21-22-19(26)20-16-10-7-6-8-11-16/h6-8,10-11,15,17,23H,3-5,9,12-14H2,1-2H3,(H,21,24)(H2,20,22,26)/t15-,17-/m1/s1