1-(1-adamantylmethyl)-3-(2,5-dimethoxyphenyl)thiourea

Systemtic Name: 1-(1-adamantylmethyl)-3-(2,5-dimethoxyphenyl)thiourea Openeye Name: 1-(1-adamantylmethyl)-3-(2,5-dimethoxyphenyl)thiourea CAS Name: 1-(1-adamantylmethyl)-3-(2,5-dimethoxyphenyl)thiourea IUPAC Name: 1-(1-adamantylmethyl)-3-(2,5-dimethoxyphenyl)thiourea Traditional Name: 1-(1-adamantylmethyl)-3-(2,5-dimethoxyphenyl)thiourea Formula: C20H28N2O2S MolecularWeight: 360.51352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H28N2O2S/c1-23-16-3-4-18(24-2)17(8-16)22-19(25)21-12-20-9-13-5-14(10-20)7-15(6-13)11-20/h3-4,8,13-15H,5-7,9-12H2,1-2H3,(H2,21,22,25)