N-(1-adamantylcarbamoyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]acetamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NN=C(S4)NC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NN=C(S4)NC5=CC=CC=C5

InChI

InChI=1S/C21H25N5O2S2/c27-17(12-29-20-26-25-19(30-20)22-16-4-2-1-3-5-16)23-18(28)24-21-9-13-6-14(10-21)8-15(7-13)11-21/h1-5,13-15H,6-12H2,(H,22,25)(H2,23,24,27,28)