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

Systemtic Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]heptanamide Openeye Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-propyl]heptanamide CAS Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]heptanamide IUPAC Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]heptanamide Traditional Name: N-[1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-propyl]enanthamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O3S/c1-5-6-7-8-12-17(26)22-18(14(2)3)19(27)23-21-25-24-20(29-21)15-10-9-11-16(13-15)28-4/h9-11,13-14,18H,5-8,12H2,1-4H3,(H,22,26)(H,23,25,27)