1-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[1-[(3-methoxyphenyl)methyl]-4-pyrazolyl]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-(1-m-anisylpyrazol-4-yl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C17H22N4O2S MolecularWeight: 346.44718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=C(C=N2)NC(=S)NCC3CCCO3

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=C(C=N2)NC(=S)NC[C@H]3CCCO3

InChI

InChI=1S/C17H22N4O2S/c1-22-15-5-2-4-13(8-15)11-21-12-14(9-19-21)20-17(24)18-10-16-6-3-7-23-16/h2,4-5,8-9,12,16H,3,6-7,10-11H2,1H3,(H2,18,20,24)/t16-/m1/s1