1-(1-adamantyl)-3-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-(1-adamantyl)-3-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-(1-adamantyl)-3-(4-pyridylmethyl)thiourea CAS Name: 1-(1-adamantyl)-3-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-(1-adamantyl)-3-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-(1-adamantyl)-3-(4-pyridylmethyl)thiourea Formula: C17H23N3S MolecularWeight: 301.44962

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NCC4=CC=NC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NCC4=CC=NC=C4

InChI

InChI=1S/C17H23N3S/c21-16(19-11-12-1-3-18-4-2-12)20-17-8-13-5-14(9-17)7-15(6-13)10-17/h1-4,13-15H,5-11H2,(H2,19,20,21)