N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-methyl-2-oxo-2-[[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]adamantane-1-carboxamide CAS Name: N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-keto-1-methyl-2-[[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]adamantane-1-carboxamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H28N4O2S/c1-13-3-5-18(6-4-13)20-26-27-22(30-20)25-19(28)14(2)24-21(29)23-10-15-7-16(11-23)9-17(8-15)12-23/h3-6,14-17H,7-12H2,1-2H3,(H,24,29)(H,25,27,28)