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

Systemtic Name: 3-(4-butylphenyl)-1-[[(2R)-oxolan-2-yl]methyl]-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(4-butylphenyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-(4-butylphenyl)-1-[[(2R)-2-oxolanyl]methyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(4-butylphenyl)-1-[[(2R)-oxolan-2-yl]methyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(4-butylphenyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]-1-(2-thenyl)thiourea Formula: C21H28N2OS2 MolecularWeight: 388.58982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC=CS3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(C[C@H]2CCCO2)CC3=CC=CS3

InChI

InChI=1S/C21H28N2OS2/c1-2-3-6-17-9-11-18(12-10-17)22-21(25)23(15-19-7-4-13-24-19)16-20-8-5-14-26-20/h5,8-12,14,19H,2-4,6-7,13,15-16H2,1H3,(H,22,25)/t19-/m1/s1