1-(1-adamantylmethyl)-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-(1-adamantylmethyl)-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-(1-adamantylmethyl)-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-(1-adamantylmethyl)-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-(1-adamantylmethyl)-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-(1-adamantylmethyl)-3-p-anisyl-thiourea Formula: C20H28N2OS MolecularWeight: 344.51412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2OS/c1-23-18-4-2-14(3-5-18)12-21-19(24)22-13-20-9-15-6-16(10-20)8-17(7-15)11-20/h2-5,15-17H,6-13H2,1H3,(H2,21,22,24)