3-cycloheptyl-1-[(1S)-1-(2-ethoxyphenyl)ethyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-cycloheptyl-1-[(1S)-1-(2-ethoxyphenyl)ethyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-cycloheptyl-1-[(1S)-1-(2-ethoxyphenyl)ethyl]-1-(3-morpholinopropyl)thiourea CAS Name: 3-cycloheptyl-1-[(1S)-1-(2-ethoxyphenyl)ethyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-cycloheptyl-1-[(1S)-1-(2-ethoxyphenyl)ethyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-cycloheptyl-1-(3-morpholinopropyl)-1-[(1S)-1-o-phenetylethyl]thiourea Formula: C25H41N3O2S MolecularWeight: 447.67694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C)N(CCCN2CCOCC2)C(=S)NC3CCCCCC3

Isomeric SMILES

CCOC1=CC=CC=C1[C@H](C)N(CCCN2CCOCC2)C(=S)NC3CCCCCC3

InChI

InChI=1S/C25H41N3O2S/c1-3-30-24-14-9-8-13-23(24)21(2)28(16-10-15-27-17-19-29-20-18-27)25(31)26-22-11-6-4-5-7-12-22/h8-9,13-14,21-22H,3-7,10-12,15-20H2,1-2H3,(H,26,31)/t21-/m0/s1