3-(4-butylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 3-(4-butylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-(4-butylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-(4-butylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 3-(4-butylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 3-(4-butylphenyl)-1-[4-(dimethylamino)benzyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C25H35N3OS MolecularWeight: 425.6299

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(C[C@H]2CCCO2)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C25H35N3OS/c1-4-5-7-20-9-13-22(14-10-20)26-25(30)28(19-24-8-6-17-29-24)18-21-11-15-23(16-12-21)27(2)3/h9-16,24H,4-8,17-19H2,1-3H3,(H,26,30)/t24-/m1/s1