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

Systemtic Name: 1-[[(2R)-2-[(2R)-3-(2-methylpropoxy)-2-oxidanyl-propyl]hexanoyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-isobutoxy-propyl]hexanoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-(2-methylpropoxy)propyl]-1-oxohexyl]amino]-3-phenylthiourea IUPAC Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-(2-methylpropoxy)propyl]hexanoyl]amino]-3-phenylthiourea Traditional Name: 1-[[(2R)-2-[(2R)-2-hydroxy-3-isobutoxy-propyl]hexanoyl]amino]-3-phenyl-thiourea Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N3O3S/c1-4-5-9-16(12-18(24)14-26-13-15(2)3)19(25)22-23-20(27)21-17-10-7-6-8-11-17/h6-8,10-11,15-16,18,24H,4-5,9,12-14H2,1-3H3,(H,22,25)(H2,21,23,27)/t16-,18-/m1/s1