1-(4,4-diethoxybutan-2-yl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(4,4-diethoxybutan-2-yl)-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(3,3-diethoxy-1-methyl-propyl)thiourea CAS Name: 1-(4,4-diethoxybutan-2-yl)-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4,4-diethoxybutan-2-yl)thiourea Traditional Name: 1-benzyl-3-(3,3-diethoxy-1-methyl-propyl)thiourea Formula: C16H26N2O2S MolecularWeight: 310.45484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(C)NC(=S)NCC1=CC=CC=C1)OCC

Isomeric SMILES

CCOC(CC(C)NC(=S)NCC1=CC=CC=C1)OCC

InChI

InChI=1S/C16H26N2O2S/c1-4-19-15(20-5-2)11-13(3)18-16(21)17-12-14-9-7-6-8-10-14/h6-10,13,15H,4-5,11-12H2,1-3H3,(H2,17,18,21)