1-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[3,5-dimethyl-1-(1-naphthylmethyl)pyrazol-4-yl]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[3,5-dimethyl-1-(1-naphthalenylmethyl)-4-pyrazolyl]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[3,5-dimethyl-1-(1-naphthylmethyl)pyrazol-4-yl]-3-(tetrahydrofurfuryl)thiourea Formula: C22H26N4OS MolecularWeight: 394.53304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC3=CC=CC=C32)C)NC(=S)NCC4CCCO4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC3=CC=CC=C32)C)NC(=S)NCC4CCCO4

InChI

InChI=1S/C22H26N4OS/c1-15-21(24-22(28)23-13-19-10-6-12-27-19)16(2)26(25-15)14-18-9-5-8-17-7-3-4-11-20(17)18/h3-5,7-9,11,19H,6,10,12-14H2,1-2H3,(H2,23,24,28)