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4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)piperazine-1-carbothioamide

4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name:4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)piperazine-1-carbothioamide
Openeye Name:4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)piperazine-1-carbothioamide
CAS Name:4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)-1-piperazinecarbothioamide
IUPAC Name:4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)piperazine-1-carbothioamide
Traditional Name:4-(1-adamantyl)-N-(3,4-dimethoxyphenyl)piperazine-1-carbothioamide
Formula: C23H33N3O2S
MolecularWeight: 415.59202
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)OC


Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)OC


InChI

InChI=1S/C23H33N3O2S/c1-27-20-4-3-19(12-21(20)28-2)24-22(29)25-5-7-26(8-6-25)23-13-16-9-17(14-23)11-18(10-16)15-23/h3-4,12,16-18H,5-11,13-15H2,1-2H3,(H,24,29)


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