1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea CAS Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H24N4O2S/c1-26-16-4-2-15(3-5-16)21-18(25)22-19-24-23-17(27-19)20-9-12-6-13(10-20)8-14(7-12)11-20/h2-5,12-14H,6-11H2,1H3,(H2,21,22,24,25)