N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]octanamide

Systemtic Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]octanamide Openeye Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-propyl]octanamide CAS Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]octanamide IUPAC Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]octanamide Traditional Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-propyl]caprylamide Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(C(C)C)C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCCCCCC(=O)NC(C(C)C)C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC

InChI

InChI=1S/C22H32N4O3S/c1-5-6-7-8-9-13-18(27)23-19(15(2)3)20(28)24-22-26-25-21(30-22)16-11-10-12-17(14-16)29-4/h10-12,14-15,19H,5-9,13H2,1-4H3,(H,23,27)(H,24,26,28)