1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C19H26N2O2S/c1-22-16-4-3-15(8-17(16)23-2)20-18(24)21-19-9-12-5-13(10-19)7-14(6-12)11-19/h3-4,8,12-14H,5-7,9-11H2,1-2H3,(H2,20,21,24)