1-(2,6-diethylphenyl)-3-(2,2-dimethylpropyl)thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-(2,2-dimethylpropyl)thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-(2,2-dimethylpropyl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-(2,2-dimethylpropyl)thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-(2,2-dimethylpropyl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-neopentyl-thiourea Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NCC(C)(C)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NCC(C)(C)C

InChI

InChI=1S/C16H26N2S/c1-6-12-9-8-10-13(7-2)14(12)18-15(19)17-11-16(3,4)5/h8-10H,6-7,11H2,1-5H3,(H2,17,18,19)