1-(1-adamantyl)-3-(2-pyridin-2-ylethyl)thiourea

Systemtic Name: 1-(1-adamantyl)-3-(2-pyridin-2-ylethyl)thiourea Openeye Name: 1-(1-adamantyl)-3-[2-(2-pyridyl)ethyl]thiourea CAS Name: 1-(1-adamantyl)-3-[2-(2-pyridinyl)ethyl]thiourea IUPAC Name: 1-(1-adamantyl)-3-(2-pyridin-2-ylethyl)thiourea Traditional Name: 1-(1-adamantyl)-3-[2-(2-pyridyl)ethyl]thiourea Formula: C18H25N3S MolecularWeight: 315.4762

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NCCC4=CC=CC=N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NCCC4=CC=CC=N4

InChI

InChI=1S/C18H25N3S/c22-17(20-6-4-16-3-1-2-5-19-16)21-18-10-13-7-14(11-18)9-15(8-13)12-18/h1-3,5,13-15H,4,6-12H2,(H2,20,21,22)